Concepedia

Computation of Ni-Cr phase diagramvia a combined first-principles quantum mechanical and CALPHAD approach

Kwai S. Chan, Yiming Pan, Yi-Der Lee

Metallurgical and Materials Transactions A · 2006 · 36 citations · 38 references

DOI

Concepts

References

38

Algebraic Representation of Thermodynamic Properties and the Classification of Solutions

O. Redlich, A. T. Kister · Industrial & Engineering Chemistry · 1948 · 5.8K citations

, , +11

Thermo-Calc & DICTRA, computational tools for materials science

J. Y. Andersson, Thomas Helander, Lars Höglund et al. · Calphad · 2002 · 4.2K citations

, , +13

Full-potential, linearized augmented plane wave programs for crystalline systems

Peter Blaha, Karlheinz Schwarz, P. Sorantin et al. · Computer Physics Communications · 1990 · 3.5K citations

, , +10

A Theory of Cooperative Phenomena

Ryoichi Kikuchi · Physical Review · 1951 · 1.9K citations

, , +16

Density-functional theory applied to phase transformations in transition-metal alloys

John Connolly, A. R. Williams · Physical review. B, Condensed matter · 1983 · 1K citations

, , +14