First Principles Calculations Results in Modelling of Phase Diagrams with Sigma-Phase
| Authors | |
|---|---|
| Year of publication | 2005 |
| Type | Article in Proceedings |
| Conference | V.Pracovní setkání fyzikálních chermiků a elektrochemiků. Sborník příspěvků |
| MU Faculty or unit | |
| Citation | |
| Field | Thermodynamics |
| Keywords | First principles; Phase diagram; Sigma-phase |
| Description | Energy of formation, calculated ab initio, was used for thermodynamic modelling of phase diagrams, containing sigma-phase. |
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