Ab-initio combined the Calphad approach to the phase equilibria in the ternary Ti-Mo-N system

R.A. Daclan, M.G. Mena, M.R. Vasquez, W. Gierlotka

Journal of Mining and Metallurgy, Section B: Metallurgy 59 (1) 125-136 (2023) · National Library of Serbia

DOI: 10.2298/jmmb210330011d

Data: JSON record · id doi:10.2298/jmmb210330011d · metadata: crossref

Roles in ORCHID

• read by ORCHID (values extracted): 42 released values
• assessment behind a TDB file: MoN-23Dac.tdb (Mo–N), MoTi-23Dac.tdb (Mo–Ti)
• discovery lead (found by Crossref assessment discovery, not read): rank 529, score 108; systems named in title: Mo–N–Ti

Systems

Mo–N, Mo–Ti, Mo–N–Ti

Evidence in ORCHID

42 values read from this paper (41 accepted), from 1 tables and 2 text passages.

Phase-registry phases citing it: phase:mo-n:bcc-a2, phase:mo-n:fcc-a1, phase:mo-n:hcp-a3, phase:mo-n:liquid, phase:mo-n:mc-shp, phase:mo-n:mo2n-b1, phase:mo-n:mo2n-beta, phase:mo-n:n2gas, phase:mo-ti:bcc-a2, phase:mo-ti:fcc-a1, phase:mo-ti:hcp-a3, phase:mo-ti:liquid

Availability

Read by ORCHID: yes (values_extracted). Open-access licence (Crossref license field): http://creativecommons.org/licenses/by-sa/4.0/ (unspecified). Crossref is-referenced-by count: 2 (retrieved 2026-10-23).

Relations

Cited by (Crossref reference lists) (1)

• The SGTE collection of binary datasets (2025) [crossref_reference_list]

References (Crossref, publisher-deposited) (11)

• The molybdenum-nitrogen phase diagram (1978) [crossref_reference_list]
• A thermodynamic evaluation of the Cr-N, Fe-N, Mo-N and Cr-Mo-N systems (1991) [crossref_reference_list]
• Ab initio lattice stability in comparison with CALPHAD lattice stability (2004) [crossref_reference_list]
• Thermodynamic modelling of Ti-Zr-N system (2017) [crossref_reference_list]
• Thermodynamic description of the Ti-Mo-Nb-Ta-Zr system and its implications for phase stability of Ti bio-implant materials (2018) [crossref_reference_list]
• Thermodynamic assessment of Mo-Ni-Ti ternary system by coupling first-principle calculations with CALPHAD approach (2010) [crossref_reference_list]
• Thermodynamic evaluation and calculation of phase equilibria of the Ti–Mo–C–N quaternary system (1999) [crossref_reference_list]
• The impact of nitrogen content and vacancies on structure and mechanical properties of Mo–N thin films (2016) [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]
• Critical Assessment and Thermodynamic Modeling of the Ti-N System (1996) [crossref_reference_list]

Cites (values carry this citation) (2)

• The impact of nitrogen content and vacancies on structure and mechanical properties of Mo–N thin films (2016) — 12 values [orchid_extraction]
• The molybdenum-nitrogen phase diagram (1978) — 1 values [orchid_extraction]

TDB files modelling its system (2)

• tdb:MoN-23Dac.tdb [sgte_tdb_header]
• tdb:MoTi-23Dac.tdb [sgte_tdb_header]

Reassesses (cites an earlier assessment of the same system) (2)

• A thermodynamic evaluation of the Cr-N, Fe-N, Mo-N and Cr-Mo-N systems (1991) [citation+same-system]
• Thermodynamic evaluation and calculation of phase equilibria of the Ti–Mo–C–N quaternary system (1999) [citation+same-system]

Data papers used (2)

• The impact of nitrogen content and vacancies on structure and mechanical properties of Mo–N thin films (2016) — 12 values [orchid_extraction]
• The molybdenum-nitrogen phase diagram (1978) — 1 values [orchid_extraction]