First-principles statistical mechanics of structural stability of intermetallic compounds

Z. W. Lu, S.-H. Wei, Alex Zunger, S. Frota-Pessoa, L. G. Ferreira

Physical Review B 44 (2) 512-544 (1991) · American Physical Society (APS)

DOI: 10.1103/physrevb.44.512

Data: JSON record · id doi:10.1103/physrevb.44.512 · metadata: crossref

Roles in ORCHID

• cited as the original source of values

Systems

Cu–Pt

Evidence in ORCHID

4 values in 1 other papers cite this work as their source.

Phase-registry phases citing it: phase:cu-pt:cupt-l11, phase:cu-pt:fcc-4sl

Availability

Read by ORCHID: no. Open-access licence (Crossref license field): none deposited. Crossref is-referenced-by count: 295 (retrieved 2026-10-23).

Relations

Cited by (Crossref reference lists) (26)

• Enthalpies of formation of Ni3Al: Experiment versus theory (1996) [crossref_reference_list]
• A combined CALPHAD/first-principles remodeling of the thermodynamics of Al–Sr: unsuspected ground state energies by “rounding up the (un)usual suspects” (2004) [crossref_reference_list]
• Effect of Ag on the precipitation stability in Al-Mg-Si-Ag alloy: First-principles calculations, Calphad modeling and experimental validation (2026) [crossref_reference_list]
• Accuracy of ab initio methods in predicting the crystal structures of metals: A review of 80 binary alloys (2005) [crossref_reference_list]
• First-principles based calculation of binary and multicomponent phase diagrams for titanium carbonitride (2008) [crossref_reference_list]
• Thermodynamic analysis of phase equilibria in the Cr–Mo–B ternary system (2010) [crossref_reference_list]
• An updated thermodynamic modeling of the Ga–Ti system (2013) [crossref_reference_list]
• Enthalpies of formation of the Al–Ni intermetallic compounds (2004) [crossref_reference_list]
• First-principles study of phase equilibria in Cu–Pt–Rh disordered alloys (2009) [crossref_reference_list]
• Internal strain effects on the phase diagram of Ni-Pt alloys (1993) [crossref_reference_list]
• Ground-state properties of ordered, partially ordered, and random Cu-Au and Ni-Pt alloys (1995) [crossref_reference_list]
• Electronic structure and phase stability study in the Ni-Ti system (1995) [crossref_reference_list]
• First-principles calculation of the pressure dependence of phase equilibria in the Al-Li system (1996) [crossref_reference_list]
• Transition-metal aluminide formation: Ti, V, Fe, and Ni aluminides (1998) [crossref_reference_list]
• A New Phase of Cu–Pt Alloy – Theoretical Prediction and Experimental Support (1996) [crossref_reference_list]
• Relativity-Induced Ordering and Phase Separation in Intermetallic Compounds (1993) [crossref_reference_list]
• Thermodynamic assessment of the Cu−Pt system (2006) [crossref_reference_list]
• Thermodynamic Analysis of the Ti-H and Zr-H Binary Phase Diagrams (2007) [crossref_reference_list]
• Thermodynamic Analysis of the Mo-Nb-B Ternary Phase Diagram (2009) [crossref_reference_list]
• Thermodynamic Analysis on the Phase Separation of hcp Phase in the Mg-Y-Zn Ternary System (2009) [crossref_reference_list]
• Thermodynamic Analysis of the V–H Binary Phase Diagram (2008) [crossref_reference_list]
• Thermodynamic Analysis of the Nb–Ti–B Ternary Phase Diagram (2009) [crossref_reference_list]
• Thermodynamic Analysis of Phase Equilibria in the Mg–Al–Ho Ternary System (2013) [crossref_reference_list]
• Thermodynamic Analysis of the Fe–Nb–B Ternary System (2008) [crossref_reference_list]
• Thermodynamic Analysis of Phase Equilibria in the Fe–Nb–P Ternary System (2009) [crossref_reference_list]
• Interplay between Lattice Distortions, Vibrations and Phase Stability in NbMoTaW High Entropy Alloys (2016) [crossref_reference_list]

References (Crossref, publisher-deposited) (6)

• Electronic-Structure calculation of ordering and segregation energies of transition metal alloys (1988) [crossref_reference_list]
• Experimental analysis of the Ni-Al phase diagram (1988) [crossref_reference_list]
• On the heat of formation of solid alloys. II (1976) [crossref_reference_list]
• Generalized cluster description of multicomponent systems (1984) [crossref_reference_list]
• Special points for Brillouin-zone integrations (1976) [crossref_reference_list]
• Electronic theory for phase stability of nine<i>AB</i>binary alloys, with<i>A=</i>Ni, Pd, or Pt and<i>B=</i>Cu, Ag, or Au (1989) [crossref_reference_list]

Cited for values by (1)

• Thermodynamic assessment of the Cu−Pt system (2006) — 4 values [orchid_extraction]

Used in (assessments / papers that took values from it) (1)

• Thermodynamic assessment of the Cu−Pt system (2006) — 4 values [orchid_extraction]