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by lochavee
Fri Feb 26, 2021 1:03 pm
Forum: Response calculations
Topic: Elastic constants of Cr
Replies: 1
Views: 416

Elastic constants of Cr

Hello everyone. I followed the tutorial about elastic constants and I wanted to see if I could successfully apply that to another element e.g. Cr. I've made convergence studies (ecut,kpoints) and plotted the corresponding band diagram (which is in very good accordance with what can be found on mater...