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The numbers (n) are for magnetism: (1) = FM (or NFM); (2) = NM; (3) = AFM; (4) = PM.","label":"2","page":10},"doi:10.1016/j.calphad.2017.09.004/p26/tab-3":{"artifact":"table","caption":"First-principles predictions of lattice parameters, enthalpies of formation, entropies of formation, zero point vibrational energies of the intermetallic compounds in the Yb-Ni system at 0K (marked by *) and ambient conditions, and their Standard Element Reference states, fcc-Yb and fcc-Ni. Available experimental data [12,13,17] are also included for comparison. The experimental data are all measured at ambient conditions.","label":"3","page":26},"doi:10.1016/j.intermet.2010.02.026/p7/tab-3":{"artifact":"table","caption":"Results of the atomistic calculations performed in this work, compared to the available literature data.","label":"3","page":7},"doi:10.1016/j.jallcom.2006.03.096/p2/tab-1":{"artifact":"table","caption":"Enthalpy of mixing �H (J/mol), equilibrium lattice parameter a (Å) and mag- netic moment β (␮ B /atom) for Ba–Ni system obtained from first-principles calculations using SQS","label":"1","page":2},"doi:10.1016/j.jallcom.2014.08.200/p4/tab-5":{"artifact":"table","caption":"Calculated energy of formation (in kJ/mol-atom) of end members of Ni 3 Ti and NiTi phase by first-principle method.","label":"5","page":4},"doi:10.1016/j.jallcom.2024.174011/p5/tab-4":{"artifact":"table","caption":"Enthalpy of formation values for sigma phases from the present work’s DFT- based calculations at 0 K.","label":"4","page":5},"doi:10.1016/j.msea.2005.02.037/p4/tab-2":{"artifact":"table","caption":"First-principles calculation results","label":"2","page":4},"doi:10.1016/j.tca.2018.08.011/p4/tab-1":{"artifact":"table","caption":"Calculated entropies at 298.15 K, S 298.15 , and enthalpies of formation at 298.15 K, ΔH 298.15 K . Comparison is made to calculated values by Berche et al.","label":"1","page":4},"sha256:01e2c117c65fb968/p2/tab-1":{"artifact":"table","caption":"Calculated total energies ( E ) and lattice parameters for fcc Co, Fe, Ni and Pt.","label":"1","page":2},"sha256:1d912ff9ab64cea0/p8/tab-2":{"artifact":"table","caption":"Comparison between SGTE and DFT lattice stabilities","label":"2","page":8},"sha256:66d905f81bb74d58/p5/tab-3":{"artifact":"table","caption":"Crystal structure of phases in the La–Ni–H system.","label":"3","page":5},"sha256:7a34c631d852730b/p3/tab-1":{"artifact":"table","caption":"Fe–Ni–Ti solid phases considered in this work: crystal structure data, temperature and composition ranges of stability, sublattice models.","label":"1","page":3},"sha256:864a974ee9a34cd4/p4/tab-2":{"artifact":"table","caption":"Calculated enthalpy of formation and cell parameters of pure elements and binary phases in Hf-Ni and Hf-Sn.","label":"2","page":4},"sha256:bcd69fa868b68ab2/p7/tab-6":{"artifact":"table","caption":"A summary of results from the first-principles calculations.","label":"6","page":7},"sha256:d74c2ece3dfbcad3/p5/tab-2":{"artifact":"table","caption":"The crystallographic data of solid phases in the La–Ni–Cu system.","label":"2","page":5},"sha256:fa1f9d709d911f4a/p42/tab-4":{"artifact":"table","caption":"The reported Curie temperature T C and magnetic moment β of fcc Ni.","label":"4","page":42}},"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. 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