[Pw_forum] charge density difference plots between two strained structures

Rajdeep Banerjee rajdeep.jzs at gmail.com
Sat Dec 6 13:38:48 CET 2014


Dear all,
             how to generate charge density difference plots (3D) for a
system between two strain values(alat is different, because alat = (1+e)*a0
where e and a0 are strain and equilibrium lattice constants respectively),
because the generated 3D grids will different for the above cases.

Thanks and regards,
Rajdeep Banerjee
PhD student
JNCASR, Bangalore,
India
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20141206/a2e63cf0/attachment.html>


More information about the users mailing list