[CP2K:3283] TZV2P basis set for Bromine

hut... at pci.uzh.ch hut... at pci.uzh.ch
Fri Jun 3 10:35:28 CEST 2011


Hi

for the heavier elements only DZVP short-range MOLOPT basis
sets are available.

regards

Juerg

--------------------------------------------------------------
Juerg Hutter                         Phone : ++41 44 635 4491
Physical Chemistry Institute   FAX   : ++41 44 635 6838
University of Zurich               E-mail:  hut... at pci.uzh.ch
Winterthurerstrasse 190
CH-8057 Zurich, Switzerland
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-----cp... at googlegroups.com wrote: -----
To: cp2k <cp... at googlegroups.com>
From: rupa 
Sent by: cp... at googlegroups.com
Date: 06/03/2011 07:15AM
Subject: [CP2K:3283] TZV2P basis set for Bromine

Hello,

I am  looking for molecularly optimized TZV2P basis set for Bromine.
I didn't find in CP2K web page. Is it developed in the mean time?

Thanks
Rupashree

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