Ab initio investigation and thermodynamic modeling of the Mo–Ti–Zr system

Chao Jiang, Robert D. Mariani, Cynthia A. Adkins

Materialia 10 100701 (2020) · Elsevier BV

DOI: 10.1016/j.mtla.2020.100701

Data: JSON record · id doi:10.1016/j.mtla.2020.100701 · metadata: crossref

Roles in ORCHID

• read by ORCHID (values extracted): 3 released values
• assessment behind a TDB file: MoTi-20Jia.tdb (Mo–Ti), MoZr-20Jia.tdb (Mo–Zr), TiZr-20Jia.tdb (Ti–Zr)
• discovery lead (found by Crossref assessment discovery, not read): rank 97, score 121; systems named in title: Mo–Ti–Zr

Systems

Mo–Ti, Mo–Zr, Ti–Zr, Mo–Ti–Zr

Evidence in ORCHID

3 values read from this paper (0 accepted), from 0 tables and 3 text passages.

Phase-registry phases citing it: phase:mo-ti:bcc-a2, phase:mo-ti:fcc-a1, phase:mo-ti:hcp-a3, phase:mo-ti:liquid, phase:mo-ti:mo2ti, phase:mo-ti:mo3ti2, phase:mo-ti:mo4ti, phase:mo-ti:mo5ti, phase:mo-ti:mo7ti, phase:mo-ti:mo9ti, phase:mo-ti:moti, phase:mo-ti:moti2, phase:mo-zr:bcc-a2, phase:mo-zr:c15-laves, phase:mo-zr:fcc-a1, phase:mo-zr:hcp-a3, phase:mo-zr:liquid, phase:ti-zr:bcc-a2, phase:ti-zr:fcc-a1, phase:ti-zr:hcp-a3 …

Availability

Read by ORCHID: yes (values_extracted). Open-access licence (Crossref license field): none deposited. Crossref is-referenced-by count: 13 (retrieved 2026-10-23).

Relations

Cited by (Crossref reference lists) (3)

• The SGTE collection of binary datasets (2025) [crossref_reference_list]
• Al-Mo-Ti Ternary Phase Diagram Evaluation (2021) [crossref_reference_list]
• Mo-Ti-Zr Ternary Phase Diagram Evaluation (2023) [crossref_reference_list]

References (Crossref, publisher-deposited) (17)

• The high temperature phase diagrams for zirconium-molybdenum and hafnium-molybdenum (1977) [crossref_reference_list]
• U-Zr (uranium-zirconium) (1993) [crossref_reference_list]
• A thermodynamic evaluation of the Ti-Mo-C system (1996) [crossref_reference_list]
• SGTE data for pure elements (1991) [crossref_reference_list]
• Thermodynamic assessment of the TiZr system and calculation of the NbTiZr phase diagram (1994) [crossref_reference_list]
• A combined first-principles/CALPHAD modeling of the Al–Ir system (2006) [crossref_reference_list]
• Thermodynamic assessment of the Mo–Zr binary phase diagram (2003) [crossref_reference_list]
• Ab initio lattice stabilities of some elemental complex structures (2006) [crossref_reference_list]
• Thermodynamic assessment of Mo-Ni-Ti ternary system by coupling first-principle calculations with CALPHAD approach (2010) [crossref_reference_list]
• Calphad thermodynamic description of some binary systems involving U (2011) [crossref_reference_list]
• The U–Ti system: Strengths and weaknesses of the CALPHAD method (2011) [crossref_reference_list]
• Diffusion studies in Hf–Mo, Zr–Mo, Cr–Nb, Cr–Ta and Th–Re systems above 1900 K (2000) [crossref_reference_list]
• Thermodynamic evaluation and calculation of phase equilibria of the Ti–Mo–C–N quaternary system (1999) [crossref_reference_list]
• Efficient iterative schemes for <i>ab initio</i> total-energy calculations using a plane-wave basis set (1996) [crossref_reference_list]
• From ultrasoft pseudopotentials to the projector augmented-wave method (1999) [crossref_reference_list]
• Generalized Gradient Approximation Made Simple (1996) [crossref_reference_list]
• Thermodynamic assessment of the Mo-Zr system (2002) [crossref_reference_list]

Cites (values carry this citation) (1)

• The high temperature phase diagrams for zirconium-molybdenum and hafnium-molybdenum (1977) — 2 values [orchid_extraction]

TDB files modelling its system (3)

• tdb:MoTi-20Jia.tdb [sgte_tdb_header]
• tdb:MoZr-20Jia.tdb [sgte_tdb_header]
• tdb:TiZr-20Jia.tdb [sgte_tdb_header]

Reassesses (cites an earlier assessment of the same system) (5)

• A thermodynamic evaluation of the Ti-Mo-C system (1996) [citation+same-system]
• Thermodynamic assessment of the TiZr system and calculation of the NbTiZr phase diagram (1994) [citation+same-system]
• Thermodynamic assessment of the Mo–Zr binary phase diagram (2003) [citation+same-system]
• Thermodynamic evaluation and calculation of phase equilibria of the Ti–Mo–C–N quaternary system (1999) [citation+same-system]
• Thermodynamic assessment of the Mo-Zr system (2002) [citation+same-system]

Data papers used (1)

• The high temperature phase diagrams for zirconium-molybdenum and hafnium-molybdenum (1977) — 2 values [orchid_extraction]