[Pw_forum] Putting a strain on a BCC

Ben Palmer benpalmer1983 at gmail.com
Tue Nov 27 18:31:49 CET 2012


Hi everyone,

I have a BCC and I'd like to put a strain on it, but I want a different
strain in each direction.  Can I specify for example celldm(1)=1.02
celldm(2)=1 celldm(3)=1, or must all three lengths be equal?  Would I need
to use another ibrav?  Sorry if there is a simple answer to this.

Thanks

Ben Palmer
PhD Student @ University of Birmingham
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