Phase diagram calculation: past, present and future

[1]  Fan Zhang,et al.  A study of microstructure and microsegregation of aluminum 7050 alloy , 2003 .

[2]  W. A. Oates,et al.  Application of the cluster-site approximation (CSA) model to the f.c.c. phase in the Ni–Al system , 2003 .

[3]  W. A. Oates,et al.  An improved approach for obtaining thermodynamic descriptions of intermetallic phases: application to the Cr–Ta system , 2001 .

[4]  Shuanglin Chen,et al.  On the Calculation of Multicomponent Stable Phase Diagrams , 2001 .

[5]  Y. Chang,et al.  A thermodynamic approach for predicting the tendency of multicomponent metallic alloys for glass formation , 2001 .

[6]  Shuang-Tin Chen,et al.  Calculated phase diagrams of aluminum alloys from binary Al–Cu to multicomponent commercial alloys , 2001 .

[7]  Xinyan Yan,et al.  Microsegregation in Al–4.5Cu wt.% alloy: experimental investigation and numerical modeling , 2001 .

[8]  T. Kraft,et al.  Importance of reliable phase equilibria in studying microsegregation in alloys: Al–Cu–Mg , 2000 .

[9]  W. A. Oates,et al.  IMPROVED CLUSTER-SITE APPROXIMATION FOR THE ENTROPY OF MIXING IN MULTICOMPONENT SOLID SOLUTIONS , 1999 .

[10]  Fanyou Xie,et al.  Microstructure and microsegregation in Al-rich Al–Cu–Mg alloys , 1999 .

[11]  A. Zunger,et al.  Evaluating and improving the cluster variation method entropy functional for Ising alloys , 1998, cond-mat/9801080.

[12]  W. Huang,et al.  Equivalence of the generalized bond-energy model, the Wagner-Schottky-type model and the compound-energy model for ordered phases , 1997 .

[13]  I. Ansara,et al.  Thermodynamic assessment of the AlNi system , 1997 .

[14]  W. A. Oates,et al.  The cluster/site approximation for multicomponent solutions — A practical alternative to the cluster variation method , 1996 .

[15]  Yong Du,et al.  Thermodynamic assessment of the AlNi system , 1996 .

[16]  W. A. Oates,et al.  On putting more physics into calphad solution models , 1996 .

[17]  W. Johnson,et al.  Formation of Ti–Zr–Cu–Ni bulk metallic glasses , 1995 .

[18]  Patrick Wollants,et al.  Thermodynamic Assessment of the Ni-Ti Phase Diagram , 1995 .

[19]  Nathalie Dupin,et al.  Thermodynamic assessment of the Cr-Ta system , 1993 .

[20]  Lee,et al.  New Monte Carlo algorithm: Entropic sampling. , 1993, Physical review letters.

[21]  McCormack,et al.  Theoretical study of alloy phase stability in the Cd-Mg system. , 1993, Physical review. B, Condensed matter.

[22]  Y. Austin Chang,et al.  On a new strategy for phase diagram calculation 2. Binary systems , 1993 .

[23]  Chou Kuo-Chih,et al.  On a New Strategy for Phase Diagram Calculation. 1. Basic Principles. , 1993 .

[24]  Shuang-Tin Chen,et al.  A thermodynamic analysis of the AlZn system and phase diagram calculation , 1993 .

[25]  U. Kattner,et al.  Thermodynamic Assessment and Calculation of the Ti-Al System , 1992, Metallurgical and Materials Transactions A.

[26]  J. Abriata,et al.  The Al-Zr (aluminum-zirconium) system , 1992 .

[27]  M. Schilfgaarde,et al.  First-principles determination of the Ni-Al phase diagram , 1992 .

[28]  G. Eriksson,et al.  ChemSage—A computer program for the calculation of complex chemical equilibria , 1990 .

[29]  Sinn-wen Chen,et al.  Phase equilibria of the Al-Li binary system , 1989 .

[30]  K. Chou,et al.  A Study of Ternary Geometrical Models , 1989 .

[31]  K. Hsieh,et al.  Thermochemical Description of the Ternary Iron-Nickel-Sulfur System , 1987 .

[32]  Per Gustafson,et al.  A thermodynamic evaluation of the C-Fe-Ni system , 1987 .

[33]  Y. Chang,et al.  A thermodynamic analysis and calculation of the Fe-Ni-Cr phase diagram , 1987, Metallurgical and Materials Transactions A.

[34]  Ferreira,et al.  Effect of chemical and elastic interactions on the phase diagrams of isostructural solids. , 1987, Physical review. B, Condensed matter.

[35]  Y. Chuang,et al.  Magnetic contributions to the thermodynamic functions of alloys and the phase equilibria of Fe-Ni system below 1200 K , 1986 .

[36]  M. Hillert,et al.  A compound-energy model of ordering in a phase with sites of different coordination numbers , 1986 .

[37]  Y. Chang,et al.  Thermodynamics and phase relationships of transition metal-sulfur systems: Part V. A reevaluation of the Fe-S system using an associated solution model for the liquid phase , 1985 .

[38]  C. Sigli,et al.  Theoretical description of phase equilibrium in binary alloys , 1985 .

[39]  Jan-Olof Andersson,et al.  The Thermo-Calc databank system☆ , 1985 .

[40]  R. Schmid A thermodynamic analysis of the Cu-O system with an associated solution model , 1983 .

[41]  R. Cahn Molybdenum: Physico-chemical properties of its compounds and alloys: (Atomic energy review, special Issue No. 7), International Atomic Energy Agency, Vienna (1980) pp 714. price: 1000 Austrian schillings , 1983 .

[42]  H. Lukas,et al.  Straegies for the calculation of phase diagrams , 1982 .

[43]  P. J. Spencer,et al.  Computer-generated phase diagrams , 1979 .

[44]  R. Sharma,et al.  Thermodynamics and phase relationships of transition metal-sulfur systems: IV. thermodynamic properties of the Ni-S liquid phase and the calculation of the Ni-S phase diagram , 1979 .

[45]  A. Pelton,et al.  On the geometrical representation of phase equilibria , 1973 .

[46]  C. Frantz,et al.  Diagramme de transformation dans l'état solide des alliages cadmium-magnésium. Etude quantitative de l'ordre à grande et à courte distance , 1971 .

[47]  J. Elliott The Physical Chemistry of Metallic Solutions and Intermetallic Compounds. , 1960 .

[48]  J. L. Meijering,et al.  Calculation of the nickel-chromium-copper phase diagram from binary data , 1957 .

[49]  J. L. Meijering,et al.  Closed miscibility gaps in ternary and quaternary regular alloy solutions , 1956 .

[50]  R. Kikuchi A Theory of Cooperative Phenomena , 1951 .

[51]  Yin-yuan Li Quasi-Chemical Method in the Statistical Theory of Regular Mixtures , 1949 .

[52]  Yin-yuan Li Quasi‐Chemical Theory of Order for the Copper Gold Alloy System , 1949 .

[53]  O. Redlich,et al.  Algebraic Representation of Thermodynamic Properties and the Classification of Solutions , 1948 .

[54]  C. N. Yang A Generalization of the Quasi‐Chemical Method in the Statistical Theory of Superlattices , 1945 .

[55]  W. Bragg,et al.  The effect of thermal agitation on atomic arrangement in alloys , 1935 .

[56]  W. A. Oates,et al.  Cluster/site approximation calculation of the ordering phase diagram for Cd–Mg alloys , 2001 .

[57]  Y. Chang,et al.  A thermodynamic analysis of the Ni?Al system , 1998 .

[58]  Rolf E. Hummel,et al.  Alloys and Compounds , 1998 .

[59]  U. Kattner,et al.  A thermodynamic description of the Ti-Al system , 1997 .

[60]  U. Kattner,et al.  A thermodynamic description of the TiAl system , 1997 .

[61]  Shuang-Tin Chen,et al.  A generalized quasi-chemical model for ordered multi-component, multi-sublattice intermetallic compounds with anti-structure defects , 1995 .

[62]  D. Fontaine Cluster Approach to Order-Disorder Transformations in Alloys , 1994 .

[63]  W. A. Oates,et al.  Bond energy model of multiple sublattice solutions using species chemical potentials. Basic theory and relation to compound energy model , 1993 .

[64]  W. A. Oates,et al.  The bond energy model for ordering in a phase with sites of different coordination numbers , 1992 .

[65]  T. I. Barry,et al.  COMPUTATIONS USING MTDATA OF METAL - MATTE - SLAG - GAS EQUILIBRIA , 1989 .

[66]  Y. Chang,et al.  Phase diagrams of ternary copper-oxygen-metal systems , 1989 .

[67]  M. Hillert,et al.  Some viewpoints on the use of a computer for calculating phase diagrams , 1981 .

[68]  J. Ågren,et al.  A regular solution model for phases with several components and sublattices, suitable for computer applications , 1981 .

[69]  D. T. Hawkins,et al.  Selected values of the thermodynamic properties of binary alloys , 1973 .

[70]  S. Kachi,et al.  An Extended Version of the Regular Solution Model for Stoichiometric Phases and Ionic Melts. , 1971 .

[71]  M. Hillert,et al.  The Regular Solution Model for Stoichiometric Phases and Ionic Melts. , 1970 .

[72]  T. Ackermann Physico-Chemical Processes in Mixed Aqueous Solvents , 1969 .

[73]  F. N. Rhines Phase Diagrams in Metallurgy Their Development and Application , 1956 .