[Pw_forum] ibrav

sandile mamba sandilemamba5 at gmail.com
Sun Jul 31 00:47:26 CEST 2016


Dear all

I want to write an input file for a molecule with 95 atoms. It does not
have a specific crystal structure. My question is, is it possible to have
such an input file in quantum espresso.

-- 
Kind Regards From

Mr Sandile Thulani Mamba

UKZN Student
Cell +268 7629 4865
Cell +27 72 956 2380
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