{"artifacts":{"sha256:94d8dcd509c0dfc5/p2/tab-1":{"artifact":"table","caption":"Symmetry and lattice parameters used in WIEN2k [18], Phonon [21] and VASP [22] (SG – space group).","label":"1","page":2},"sha256:94d8dcd509c0dfc5/p3/tab-2":{"artifact":"table","caption":"� Enthalpy of formation, D f H 0 , the phonon (ph.) and electron (el.) contribution to � �","label":"2","page":3}},"cite_as":{"also_cite":["the original source of every value you use (paper_citation / paper_doi, and cited_dois for values the paper cites from earlier work)"],"bibtex":"@misc{orchid_literature_2026,\n  author    = {Arr{\\'o}yave, Raymundo and Saal, James and Shin, Dongwon},\n  title     = {{ORCHID-Values: thermodynamic and phase-equilibrium values read from the literature}},\n  version   = {2026.10},\n  publisher = {Zenodo},\n  year      = {2026},\n  doi       = {10.5281/zenodo.23735569},\n  url       = {https://doi.org/10.5281/zenodo.23735569},\n  note      = {Version 1, machine-extracted}\n}","dataset":"literature","doi":"10.5281/zenodo.23735569","license":"CC-BY-4.0","part_of":{"bibtex":"@misc{orchid_data_2026,\n  author    = {Arr{\\'o}yave, Raymundo and Saal, James and Shin, Dongwon},\n  title     = {{ORCHID data: umbrella record of the ORCHID datasets}},\n  version   = {2026.10},\n  publisher = {Zenodo},\n  year      = {2026},\n  doi       = {10.5281/zenodo.23736065},\n  url       = {https://doi.org/10.5281/zenodo.23736065},\n  note      = {Version 1, machine-extracted}\n}","doi":"10.5281/zenodo.23736065","text":"R. Arróyave, J. Saal, D. Shin, ORCHID data: umbrella record of the ORCHID datasets (version 2026.10; Version 1, machine-extracted), Zenodo (2026). https://doi.org/10.5281/zenodo.23736065","title":"ORCHID data: umbrella record of the ORCHID datasets","url":"https://doi.org/10.5281/zenodo.23736065"},"release_tag":"v2026.10","status":"Version 1, machine-extracted: values were read by language-model readers constrained to quote their source and checked automatically, and the release was then audited on the printed pages by adversarial audits, an independent second review of fit-facing records and a preliminary human review of a frozen sample. Flags such as accepted and ESPEI-ready record screening results, not certification; known issues are listed in the release notes.","text":"R. Arróyave, J. Saal, D. Shin, ORCHID-Values: thermodynamic and phase-equilibrium values read from the literature (version 2026.10; Version 1, machine-extracted), Zenodo (2026). https://doi.org/10.5281/zenodo.23735569","title":"ORCHID-Values: thermodynamic and phase-equilibrium values read from the literature","url":"https://doi.org/10.5281/zenodo.23735569","version":"2026.10"},"contexts":{},"elements":["AL","NP"],"licence":"CC BY 4.0 (ORCHID data; quotes are short excerpts kept for verification, the publishers' copyright, not relicensed)","models":{},"note":"records[].locator.ref -> artifacts; records[].model -> models (full records: orchid-literature.jsonl.gz)","papers":{"doi:10.1016/0022-3115(74)90035-x":{"authors":["A.W. Mitchell","D.J. Lam"],"citation":"A.W. Mitchell, D.J. Lam, Crystal structures of intermediate phases in several neptunium binary alloys, Journal of Nuclear Materials 52, 125-127 (1974).","container":"Journal of Nuclear Materials","doi":"10.1016/0022-3115(74)90035-x","doi_url":"https://doi.org/10.1016/0022-3115(74)90035-x","id":"doi:10.1016/0022-3115(74)90035-x","kind":"cited_work","metadata_source":"crossref","roles":["cited_source"],"source_kinds":["cited_work"],"title":"Crystal structures of intermediate phases in several neptunium binary alloys","year":1974},"doi:10.1016/j.jnucmat.2009.11.023":{"authors":["D. Sedmidubský","R.J.M. Konings","P. Souček"],"citation":"D. Sedmidubský, R.J.M. Konings, P. Souček, Ab-initio calculations and phase diagram assessments of An–Al systems (An= U, Np, Pu), Journal of Nuclear Materials 397, 1-7 (2010).","container":"Journal of Nuclear Materials","doi":"10.1016/j.jnucmat.2009.11.023","doi_url":"https://doi.org/10.1016/j.jnucmat.2009.11.023","id":"doi:10.1016/j.jnucmat.2009.11.023","kind":"corpus_paper","metadata_source":"crossref","pdf_sha256_prefix":"94d8dcd509c0dfc5","roles":["reporting_paper"],"source_kinds":["journal_article"],"title":"Ab-initio calculations and phase diagram assessments of An–Al systems (An= U, Np, Pu)","year":2010}},"part":1,"parts":1,"records":[{"chemical_system":"AL-NP","cited_sources":[{"first_author":"Runnalls","kind":"unknown","label":"24","reference":"O. Runnalls, J. Metals 5 (1953) 1460.","status":"resolved","year":"1953"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl2","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl2 | SG Fd-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 2; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl2","space_group":"Fd-3m"},"before":null,"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl2 | SG Fd-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 2; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-KKDB6SSKIZ.1336a3","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":2},"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r02#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_B","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl2","space_group":"Fd-3m"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.0005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.07785,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.07785},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.0005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":7.785,"value_stored":7.785},{"chemical_system":"AL-NP","cited_sources":[{"first_author":"Runnalls","kind":"unknown","label":"24","reference":"O. Runnalls, J. Metals 5 (1953) 1460.","status":"resolved","year":"1953"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl2","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl2 | SG Fd-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 2; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl2","space_group":"Fd-3m"},"before":null,"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl2 | SG Fd-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 2; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-KKDB6SSKIZ.4e4ec9","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":2},"merged_ids":["ORC-KKDB6SSKIZ.6ca9c7"],"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r02#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_A","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl2","space_group":"Fd-3m"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.0005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.07785,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.07785},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.0005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":7.785,"value_stored":7.785},{"chemical_system":"AL-NP","cited_sources":[{"first_author":"Runnalls","kind":"unknown","label":"24","reference":"O. Runnalls, J. Metals 5 (1953) 1460.","status":"resolved","year":"1953"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl2","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl2 | SG Fd-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 2; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl2","space_group":"Fd-3m"},"before":null,"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl2 | SG Fd-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 2; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-KKDB6SSKIZ.9eed59","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":2},"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r02#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_C","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl2","space_group":"Fd-3m"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.0005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.07785,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.07785},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.0005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":7.785,"value_stored":7.785},{"chemical_system":"AL-NP","cited_sources":[{"doi":"10.1016/0022-3115(74)90035-x","first_author":"Mitchell","kind":"unknown","label":"27","paper":"doi:10.1016/0022-3115(74)90035-x","reference":"A. Mitchell, D. Lam, J. Nucl. Mater. 52 (1974) 125.","status":"resolved","year":"1974"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl3","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl3 | SG Pm-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 5; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl3","space_group":"Pm-3m"},"before":null,"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl3 | SG Pm-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 5; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-Y4IPYOKVTQ.052594","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":5},"merged_ids":["ORC-Y4IPYOKVTQ.5e43fd"],"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r05#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_A","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl3","space_group":"Pm-3m"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.0426,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.0426},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":4.26,"value_stored":4.26},{"chemical_system":"AL-NP","cited_sources":[{"doi":"10.1016/0022-3115(74)90035-x","first_author":"Mitchell","kind":"unknown","label":"27","paper":"doi:10.1016/0022-3115(74)90035-x","reference":"A. Mitchell, D. Lam, J. Nucl. Mater. 52 (1974) 125.","status":"resolved","year":"1974"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl3","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl3 | SG Pm-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 5; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl3","space_group":"Pm-3m"},"before":null,"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl3 | SG Pm-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 5; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-Y4IPYOKVTQ.09c83b","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":5},"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r05#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_C","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl3","space_group":"Pm-3m"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.0426,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.0426},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":4.26,"value_stored":4.26},{"chemical_system":"AL-NP","cited_sources":[{"doi":"10.1016/0022-3115(74)90035-x","first_author":"Mitchell","kind":"unknown","label":"27","paper":"doi:10.1016/0022-3115(74)90035-x","reference":"A. Mitchell, D. Lam, J. Nucl. Mater. 52 (1974) 125.","status":"resolved","year":"1974"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl3","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl3 | SG Pm-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 5; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl3","space_group":"Pm-3m"},"before":null,"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl3 | SG Pm-3m (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 5; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-Y4IPYOKVTQ.410483","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":5},"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r05#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_B","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl3","space_group":"Pm-3m"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.0426,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.0426},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":4.26,"value_stored":4.26},{"chemical_system":"AL-NP","cited_sources":[{"first_author":"Runnalls","kind":"unknown","label":"7","reference":"O. Runnalls, Trans. Am. Inst. Min., Metall. Petrol. Eng. 197 (1953) 1460.","status":"resolved","year":"1953"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl4","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl4 | SG Imma (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 9; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl4","space_group":"Imma"},"before":{"space_group":"Imma"},"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl4 | SG Imma (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 9; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-HE33UGZGDO.05e853","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":9},"merged_ids":["ORC-HE33UGZGDO.e64a37"],"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r09#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_B","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl4","space_group":"Imma"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.0626,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.0626},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":6.26,"value_stored":6.26},{"chemical_system":"AL-NP","cited_sources":[{"first_author":"Runnalls","kind":"unknown","label":"7","reference":"O. Runnalls, Trans. Am. Inst. Min., Metall. Petrol. Eng. 197 (1953) 1460.","status":"resolved","year":"1953"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl4","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl4 | SG Imma (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 9; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl4","space_group":"Imma"},"before":{"space_group":"Imma"},"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl4 | SG Imma (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 9; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-HE33UGZGDO.113d8b","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":9},"merged_ids":["ORC-HE33UGZGDO.5b5aa4"],"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r09#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_A","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl4","space_group":"Imma"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.0442,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.0442},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":4.42,"value_stored":4.42},{"chemical_system":"AL-NP","cited_sources":[{"first_author":"Runnalls","kind":"unknown","label":"7","reference":"O. Runnalls, Trans. Am. Inst. Min., Metall. Petrol. Eng. 197 (1953) 1460.","status":"resolved","year":"1953"}],"conditions":{"kind":"cited_source","note":"conditions in the cited source"},"corrections":[{"after":[{"label":"NpAl4","label_source":"printed_source_page"}],"before":[{"label":"UNKNOWN"}],"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl4 | SG Imma (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"phases","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 9; no group inheritance needed","verdict":"confirmed"}},{"after":{"phase":"NpAl4","space_group":"Imma"},"before":{"space_group":"Imma"},"evidence":{"batch":"table_context_batch_04","doi":"10.1016/j.jnucmat.2009.11.023","pdf_page":2,"pdf_sha256":"94d8dcd509c0dfc52c8595b9491d05743da4ffb905be9736aafce61242ada788","printed":"Row label NpAl4 | SG Imma (row-printed; a,b,c values match)","rationale":"Printed table context for this group supplies phase, space_group; shared fields only, row values, references, uncertainty, composition and conditions unchanged; no forward fill across groups and no inference from symmetry, composition or other papers.","report_id":"ORCHID-TC-20261027-v1","source_group_rows":null,"table":"1","table_key":"t062"},"field":"structure","gate":"TC20261027","rule":"source_adjudicated_table_context","visual_check":{"checked":"2026-10-27; Claude rendered-page inspection, table-context batch 04","image_sha256":"dd568c6b65f3fb4c2513e6754a5313f35f29fd93d2d414311a5433a21bcfcadd","page":2,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"single printed row 9; no group inheritance needed","verdict":"confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"review_state":"extracted","specification_gaps":["state:computation_context","table_context_correction_requires_downstream_revalidation"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"id":"ORC-HE33UGZGDO.2ad016","locator":{"ref":"sha256:94d8dcd509c0dfc5/p2/tab-1","row":9},"merged_ids":["ORC-HE33UGZGDO.ef21a4"],"observation_type":"structural_property","origin":{"basis":"caption_names_first_principles_only","class":"computed","own_work_of_paper":false},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4","label_source":"printed_source_page"}],"pid":"sha256:94d8dcd509c0dfc5/p2/tab-1/r09#structural_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"LATTICE_C","property_group":"crystal structure","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","structure":{"phase":"NpAl4","space_group":"Imma"},"system":"AL-NP","temperature_K":298.15,"temperature_basis":"assumed_room_temperature","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"reading_resolution","value":0.005},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":0.1371,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/LATTICE_LENGTH","floor":0.01,"floor_unit":"relative (fraction of the value)","value":0.1371},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"Å","value_type":"LATTICE_LENGTH"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"Å","unit_stored":"Å","value":13.71,"value_stored":13.71},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"electronic","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"HEAT_CONTENT_CONTRIBUTION","before":"HEAT_CONTENT","evidence":{"contribution":"electronic","printed":"H°298 - H°0 (el.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"contribution_not_a_total","detail":"electronic contribution to HEAT_CONTENT","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-AZTCA3FNXM.0e9937","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":2},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r02#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HEAT_CONTENT_CONTRIBUTION","property_code_before_gates":"HEAT_CONTENT","property_group":"heat capacity / entropy / enthalpy","property_printed":"H°298 - H°0 (el.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.039},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"kJ mol^-1","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ mol^-1","unit_basis":"column_header","unit_printed":"kJ mol^-1","value":0.78,"value_printed":0.78},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"electronic","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"SM_CONTRIBUTION","before":"SM","evidence":{"contribution":"electronic","printed":"S°298 (el.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree","contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA12","effect":"not_espei_ready","gate":"G7"},{"code":"contribution_not_a_total","detail":"electronic contribution to SM","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-AZTCA3FNXM.51c254","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":2},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r02#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_CONTRIBUTION","property_code_before_gates":"SM","property_group":"heat capacity / entropy / enthalpy","property_printed":"S°298 (el.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.26},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property SM_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property SM_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":5.2,"value_printed":5.2},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"phonon","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"HEAT_CONTENT_CONTRIBUTION","before":"HEAT_CONTENT","evidence":{"contribution":"phonon","printed":"H°298 - H°0 (ph.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"contribution_not_a_total","detail":"phonon contribution to HEAT_CONTENT","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-AZTCA3FNXM.5c0b4d","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":2},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r02#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HEAT_CONTENT_CONTRIBUTION","property_code_before_gates":"HEAT_CONTENT","property_group":"heat capacity / entropy / enthalpy","property_printed":"H°298 - H°0 (ph.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":1.21},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"kJ mol^-1","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ mol^-1","unit_basis":"column_header","unit_printed":"kJ mol^-1","value":24.2,"value_printed":24.2},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree"],"review_state":"extracted","specification_gaps":["reference-dependent quantity without a resolved reference state","state:T_K","state:reference_state","temperature not stated"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA12","effect":"not_espei_ready","gate":"G7"}],"id":"ORC-AZTCA3FNXM.771663","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":2},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r02#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HM_FORM","property_group":"formation","property_printed":"ΔfH°0","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","reference_state":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"}},"reference_state_stored":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"},"PU":{"phase":"printed:none"},"U":{"phase":"printed:none"}},"source_system":"AL-NP-PU-U","system":"AL-NP","temperature_basis":"not_printed","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":5.51},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":25.18,"sigma_method":{"basis":"calibrated","ci95":[6.672,9.877],"class":"dft","entry":"dft/literature/strata/metal","floor":8.395,"floor_unit":"kJ/mol-atom","n_pairs":230,"scaled_for_unstated_basis":3,"stratum":"literature/metal","value":25.18},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"kJ/mol (basis unstated)","value_type":"HM_FORM"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ/mol (basis unstated)","unit_basis":"column_header","unit_printed":"kJ mol^-1","unit_stored":"J/mol (basis unstated)","value":-110.2,"value_printed":-110.2,"value_stored":-110200.0},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"phonon","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"SM_CONTRIBUTION","before":"SM","evidence":{"contribution":"phonon","printed":"S°298 (ph.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree","contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA12","effect":"not_espei_ready","gate":"G7"},{"code":"contribution_not_a_total","detail":"phonon contribution to SM","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-AZTCA3FNXM.a40735","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":2},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r02#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_CONTRIBUTION","property_code_before_gates":"SM","property_group":"heat capacity / entropy / enthalpy","property_printed":"S°298 (ph.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":4.975},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property SM_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property SM_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":99.5,"value_printed":99.5},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.333333,"PU":0.0,"U":0.0},"phases":["NpAl2"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree"],"review_state":"extracted","specification_gaps":["reference-dependent quantity without a resolved reference state","state:reference_state"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA12","effect":"not_espei_ready","gate":"G7"}],"id":"ORC-AZTCA3FNXM.c17dc6","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":2},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.333333},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.333333,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl2"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r02#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_FORM","property_group":"formation","property_printed":"ΔfS°298","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","reference_state":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"}},"reference_state_stored":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"},"PU":{"phase":"printed:none"},"U":{"phase":"printed:none"}},"source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.115},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":3.0,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/SM_FORM","floor":1.0,"floor_unit":"J/K/mol-atom","scaled_for_unstated_basis":3,"value":3.0},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":"SM_FORM"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":-2.3,"value_printed":-2.3},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"phonon","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"HEAT_CONTENT_CONTRIBUTION","before":"HEAT_CONTENT","evidence":{"contribution":"phonon","printed":"H°298 - H°0 (ph.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"contribution_not_a_total","detail":"phonon contribution to HEAT_CONTENT","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-MQPU74X72L.00d8ef","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":5},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r05#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HEAT_CONTENT_CONTRIBUTION","property_code_before_gates":"HEAT_CONTENT","property_group":"heat capacity / entropy / enthalpy","property_printed":"H°298 - H°0 (ph.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":1.605},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"kJ mol^-1","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ mol^-1","unit_basis":"column_header","unit_printed":"kJ mol^-1","value":32.1,"value_printed":32.1},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree"],"review_state":"extracted","specification_gaps":["reference-dependent quantity without a resolved reference state","state:reference_state"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA13","effect":"not_espei_ready","gate":"G7"}],"id":"ORC-MQPU74X72L.116bfa","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":5},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r05#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_FORM","property_group":"formation","property_printed":"ΔfS°298","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","reference_state":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"}},"reference_state_stored":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"},"PU":{"phase":"printed:none"},"U":{"phase":"printed:none"}},"source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.605},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":4.0,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/SM_FORM","floor":1.0,"floor_unit":"J/K/mol-atom","scaled_for_unstated_basis":4,"value":4.0},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":"SM_FORM"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":-12.1,"value_printed":-12.1},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree"],"review_state":"extracted","specification_gaps":["reference-dependent quantity without a resolved reference state","state:T_K","state:reference_state","temperature not stated"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA13","effect":"not_espei_ready","gate":"G7"}],"id":"ORC-MQPU74X72L.3dbd0b","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":5},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r05#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HM_FORM","property_group":"formation","property_printed":"ΔfH°0","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","reference_state":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"}},"reference_state_stored":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"},"PU":{"phase":"printed:none"},"U":{"phase":"printed:none"}},"source_system":"AL-NP-PU-U","system":"AL-NP","temperature_basis":"not_printed","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":6.145},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":33.58,"sigma_method":{"basis":"calibrated","ci95":[6.672,9.877],"class":"dft","entry":"dft/literature/strata/metal","floor":8.395,"floor_unit":"kJ/mol-atom","n_pairs":230,"scaled_for_unstated_basis":4,"stratum":"literature/metal","value":33.58},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"kJ/mol (basis unstated)","value_type":"HM_FORM"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ/mol (basis unstated)","unit_basis":"column_header","unit_printed":"kJ mol^-1","unit_stored":"J/mol (basis unstated)","value":-122.9,"value_printed":-122.9,"value_stored":-122900.0},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"phonon","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"SM_CONTRIBUTION","before":"SM","evidence":{"contribution":"phonon","printed":"S°298 (ph.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree","contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA13","effect":"not_espei_ready","gate":"G7"},{"code":"contribution_not_a_total","detail":"phonon contribution to SM","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-MQPU74X72L.929885","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":5},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r05#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_CONTRIBUTION","property_code_before_gates":"SM","property_group":"heat capacity / entropy / enthalpy","property_printed":"S°298 (ph.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":6.03},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property SM_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property SM_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":120.6,"value_printed":120.6},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"electronic","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"SM_CONTRIBUTION","before":"SM","evidence":{"contribution":"electronic","printed":"S°298 (el.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree","contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA13","effect":"not_espei_ready","gate":"G7"},{"code":"contribution_not_a_total","detail":"electronic contribution to SM","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-MQPU74X72L.b02fa5","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":5},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r05#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_CONTRIBUTION","property_code_before_gates":"SM","property_group":"heat capacity / entropy / enthalpy","property_printed":"S°298 (el.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.13},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property SM_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property SM_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":2.6,"value_printed":2.6},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"electronic","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"HEAT_CONTENT_CONTRIBUTION","before":"HEAT_CONTENT","evidence":{"contribution":"electronic","printed":"H°298 - H°0 (el.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.25,"PU":0.0,"U":0.0},"phases":["NpAl3"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"contribution_not_a_total","detail":"electronic contribution to HEAT_CONTENT","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-MQPU74X72L.f58e98","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":5},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.25},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.25,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl3"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r05#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HEAT_CONTENT_CONTRIBUTION","property_code_before_gates":"HEAT_CONTENT","property_group":"heat capacity / entropy / enthalpy","property_printed":"H°298 - H°0 (el.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.0195},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"kJ mol^-1","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ mol^-1","unit_basis":"column_header","unit_printed":"kJ mol^-1","value":0.39,"value_printed":0.39},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree"],"review_state":"extracted","specification_gaps":["reference-dependent quantity without a resolved reference state","state:T_K","state:reference_state","temperature not stated"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA14","effect":"not_espei_ready","gate":"G7"}],"id":"ORC-UCH5KWJ6UG.10f4d8","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":10},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r10#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HM_FORM","property_group":"formation","property_printed":"ΔfH°0","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","reference_state":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"}},"reference_state_stored":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"},"PU":{"phase":"printed:none"},"U":{"phase":"printed:none"}},"source_system":"AL-NP-PU-U","system":"AL-NP","temperature_basis":"not_printed","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":5.28},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":41.97,"sigma_method":{"basis":"calibrated","ci95":[6.672,9.877],"class":"dft","entry":"dft/literature/strata/metal","floor":8.395,"floor_unit":"kJ/mol-atom","n_pairs":230,"scaled_for_unstated_basis":5,"stratum":"literature/metal","value":41.97},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"kJ/mol (basis unstated)","value_type":"HM_FORM"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ/mol (basis unstated)","unit_basis":"column_header","unit_printed":"kJ mol^-1","unit_stored":"J/mol (basis unstated)","value":-105.6,"value_printed":-105.6,"value_stored":-105600.0},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"electronic","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"HEAT_CONTENT_CONTRIBUTION","before":"HEAT_CONTENT","evidence":{"contribution":"electronic","printed":"H°298 - H°0 (el.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"contribution_not_a_total","detail":"electronic contribution to HEAT_CONTENT","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-UCH5KWJ6UG.63befd","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":10},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r10#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HEAT_CONTENT_CONTRIBUTION","property_code_before_gates":"HEAT_CONTENT","property_group":"heat capacity / entropy / enthalpy","property_printed":"H°298 - H°0 (el.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.0255},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.005},"sigma_scatter":null,"unit":"kJ mol^-1","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ mol^-1","unit_basis":"column_header","unit_printed":"kJ mol^-1","value":0.51,"value_printed":0.51},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"phonon","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"HEAT_CONTENT_CONTRIBUTION","before":"HEAT_CONTENT","evidence":{"contribution":"phonon","printed":"H°298 - H°0 (ph.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"contribution_not_a_total","detail":"phonon contribution to HEAT_CONTENT","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-UCH5KWJ6UG.697eb5","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":10},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r10#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"HEAT_CONTENT_CONTRIBUTION","property_code_before_gates":"HEAT_CONTENT","property_group":"heat capacity / entropy / enthalpy","property_printed":"H°298 - H°0 (ph.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":2.025},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property HEAT_CONTENT_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"kJ mol^-1","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"kJ mol^-1","unit_basis":"column_header","unit_printed":"kJ mol^-1","value":40.5,"value_printed":40.5},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree"],"review_state":"extracted","specification_gaps":["reference-dependent quantity without a resolved reference state","state:reference_state"],"state_fully_specified":false,"system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA14","effect":"not_espei_ready","gate":"G7"}],"id":"ORC-UCH5KWJ6UG.910022","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":10},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r10#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_FORM","property_group":"formation","property_printed":"ΔfS°298","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","reference_state":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"}},"reference_state_stored":{"AL":{"phase":"printed:none"},"NP":{"phase":"printed:none"},"PU":{"phase":"printed:none"},"U":{"phase":"printed:none"}},"source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.405},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":5.0,"sigma_method":{"basis":"prior","class":"dft","entry":"dft/priors/SM_FORM","floor":1.0,"floor_unit":"J/K/mol-atom","scaled_for_unstated_basis":5,"value":5.0},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":"SM_FORM"}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":-8.1,"value_printed":-8.1},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"phonon","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"SM_CONTRIBUTION","before":"SM","evidence":{"contribution":"phonon","printed":"S°298 (ph.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree","contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA14","effect":"not_espei_ready","gate":"G7"},{"code":"contribution_not_a_total","detail":"phonon contribution to SM","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-UCH5KWJ6UG.a9231d","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":10},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r10#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_CONTRIBUTION","property_code_before_gates":"SM","property_group":"heat capacity / entropy / enthalpy","property_printed":"S°298 (ph.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":7.605},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property SM_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property SM_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":152.1,"value_printed":152.1},{"chemical_system":"AL-NP","conditions":{"kind":"not_applicable_own_calculation"},"contribution":"electronic","corrections":[{"after":"dft","before":"model","evidence":{"printed":null},"field":"evidence_class","gate":"page","rule":"first_principles_value_coded_model","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"Table 2 (section 3.1 Ab-initio calculations; Fig. 2 caption and text tie Table 2 to the Wien2k / VASP calculations of this paper): calculated enthalpies, phonon and electronic contributions of UAl2 / NpAl2 / UAl3. First-principles values.","verdict":"corrected"}},{"after":"SM_CONTRIBUTION","before":"SM","evidence":{"contribution":"electronic","printed":"S°298 (el.)"},"field":"property","gate":"R3","rule":"contribution_stored_as_total","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}},{"after":"AL-NP","before":"AL-NP-PU-U","evidence":{"basis":"phase_formula","overall_composition":{"NP":0.2,"PU":0.0,"U":0.0},"phases":["NpAl4"]},"field":"system","gate":"A1","rule":"system_of_the_state"}],"evidence_class":"dft","evidence_class_before_gates":"model","flags":{"calphad_check":"not_available","espei_certified":false,"espei_ready":false,"extraction_accepted":true,"gate_failures":["phase_label_readings_disagree","contribution_not_a_total"],"review_state":"extracted","system_is_state_subsystem":true},"fold_lpo":1,"fold_lso":0,"gate_failures":[{"code":"phase_label_readings_disagree","detail":"the same printed value is also stored with phase(s) NpA14","effect":"not_espei_ready","gate":"G7"},{"code":"contribution_not_a_total","detail":"electronic contribution to SM","effect":"not_espei_ready","gate":"R3","visual_check":{"checked":"2026-10-24","image_sha256":"d01a371b8676dfdf1107378005b484f0e72817f4ad1f99bd518ed1a361edf968","page":3,"pdf_sha256_prefix":"94d8dcd509c0dfc5","seen":"S°298 (el.) is the electronic part of S298 (phonon part listed separately); Cp mag at 298.15 K is the magnetic contribution.","verdict":"rule_confirmed"}}],"id":"ORC-UCH5KWJ6UG.d47891","locator":{"ref":"sha256:94d8dcd509c0dfc5/p3/tab-2","row":10},"model_unlinked_reason":"reporting paper's own calculation, but no TDB linked to the table","observation_type":"equilibrium_property","origin":{"basis":"this_work+paper_text_states_calculated","class":"model_value","class_gate":"first-principles (DFT) value","measured_in":"doi:10.1016/j.jnucmat.2009.11.023","own_work_of_paper":true},"overall_composition":{"NP":0.2},"overall_composition_basis":"from_formula","overall_composition_stored":{"NP":0.2,"PU":0.0,"U":0.0},"paper":"doi:10.1016/j.jnucmat.2009.11.023","paper_id":"doi:10.1016/j.jnucmat.2009.11.023","phases":[{"label":"NpAl4"}],"pid":"sha256:94d8dcd509c0dfc5/p3/tab-2/r10#equilibrium_property","pressure_Pa":101325,"pressure_basis":"assumed_default_1_atm_not_printed","pressure_basis_stored":"unstated_assumed","property":"SM_CONTRIBUTION","property_code_before_gates":"SM","property_group":"heat capacity / entropy / enthalpy","property_printed":"S°298 (el.)","reader_agreement":"multi_reader","reader_agreement_label":"confirmed (two or more readers)","reader_tier":"preliminary_flash+claude","readers":["claude-opus-5.5","gemini-3.8-flash","text_layer"],"record_kind":"general_table","source_system":"AL-NP-PU-U","system":"AL-NP","temperature_K":298.15,"temperature_basis":"quantity_label","temperature_printed":"298","tool_release":"tools-release-v2.1.18","uncertainty":{"basis":"stated_default","note":"5% default","value":0.17},"uncertainty_budget":{"calibration":"orchid-uncertainty-calibration 2026-10-24 (audit round 2) sha256 6a2b5a92b0ec","quantities":{"value":{"sigma_composition":null,"sigma_conversion":null,"sigma_effective":null,"sigma_effective_reason":"no method floor defined for property SM_CONTRIBUTION","sigma_method":{"reason":"no method floor defined for property SM_CONTRIBUTION","value":null},"sigma_printed":null,"sigma_reading":{"basis":"last_printed_digit","value":0.05},"sigma_scatter":null,"unit":"J/mol (basis unstated)/K","value_type":null}},"sigma_rule":"max(sqrt(max(printed, reading, method)^2 + composition^2 + conversion^2), scatter)"},"unit":"J/mol (basis unstated)/K","unit_basis":"column_header","unit_printed":"J mol^-1 K^-1","value":3.4,"value_printed":3.4}],"release":"orchid-literature 2026-10-23 (record store db-v2.1: invariant/general v2.1.19r, text+context fixup-20261022)","system":"AL-NP"}