[CP2K:6157] Re: polarizability calculations
hut... at chem.uzh.ch
hut... at chem.uzh.ch
Wed Feb 25 14:40:07 UTC 2015
Hi
I cannot see to what message you refer to.
Polarizability calculations should work without problems for GGA
functionals (like PBE).
regards
Juerg
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Juerg Hutter Phone : ++41 44 635 4491
Institut für Chemie C FAX : ++41 44 635 6838
Universität Zürich E-mail: hut... at chem.uzh.ch
Winterthurerstrasse 190
CH-8057 Zürich, Switzerland
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-----cp... at googlegroups.com wrote: -----To: cp... at googlegroups.com
From: marta bon
Sent by: cp... at googlegroups.com
Date: 02/25/2015 12:25PM
Subject: [CP2K:6157] Re: polarizability calculations
Dear CP2K users,
I came across this message and I have the following question: is it right that I cannot calculate the polarizability tensor with the PBE exchange correlation functional?
Thank you very much.
Marta
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