Multiscale Modelling of Stability of Laves Phases in Cr-Zr System

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Authors	PAVLŮ Jana VŘEŠŤÁL Jan
Year of publication	2008
Type	Conference abstract
MU Faculty or unit	Faculty of Science
Citation
Description	The ab initio total energy differences are compared with structural stabilities calculated in literature and adopted for modelling of phase diagram.
Related projects:	Physical and chemical properties of advanced materials and structures Theoretical and experimental investigations of thermodynamic properties in transition metal based intermetallic phases Multiscale modelling of structure and properties of intermetallic phases