Non-Stoichiometry and Calphad Modeling of Frank-Kasper Phases

Comparison of the Site Occupancies Determined by Combined Rietveld Refinement and Density Functional Theory Calculations: Example of the Ternary Mo–Ni–Re σ Phase

(2012) Khurram Yaqoob et al.   INORGANIC CHEMISTRY

An improved thermodynamic modeling of the Fe–Cr system down to zero kelvin coupled with key experiments

(2011) Wei Xiong et al.   CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY

Ab initio ternary -phase diagram: The Cr–Mo–Re system

(2010) J.-C. Crivello et al.   CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY

Resonant X-ray diffraction study and electronic structure calculations of three Mo–Ru–Si ternary phases

(2010) Janusz Tobola et al.   INTERMETALLICS

Vibrational Properties ofα- andσ-Phase Fe-Cr Alloy

(2010) S. M. Dubiel et al.   PHYSICAL REVIEW LETTERS

Thermodynamic assessment of the Molybdenum–Rhenium system

(2009) S.A. Farzadfar et al.   CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY

Ab initio study of formation energy and magnetism of sigma phase in Cr–Fe and Cr–Co systems

(2009) J. Pavlů et al.   INTERMETALLICS

Magnetic ordering above room temperature in the sigma-phase of Fe66V34

(2009) Jakub Cieślak et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

First principles calculations of the σ and χ phases in the Mo–Re and W–Re systems

(2009) J-C Crivello et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Crystal chemistry and Calphad modelling of the χ phase

(2009) J.-M. Joubert et al.   PROGRESS IN MATERIALS SCIENCE

Thermodynamic modeling and optimization of the Fe–Ni–Ti system

(2008) Jozefien De Keyzer et al.   CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY

Crystal chemistry and Calphad modeling of the σ phase

(2007) J.-M. Joubert   PROGRESS IN MATERIALS SCIENCE