Computing Elastic Constants for High Entropy Alloys

Elastic Constants for High Entropy Alloys

*) The exciting code uses atomic units.
*) You need to adapt the code to create input files for VASP.
*) The strain vector must be chosen carefully, a large value leads to a phase transition.
*) Relaxation of the coordinates must be adapted according to the problem.

#ElasticConstants #HighEntropyAlloys #VASP
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