[CP2K:6673] BASIS SET GENERATION

[hut... at chem.uzh.ch]

Hi

have a look at the regtests Ru*.inp in
../tests/ATOM/regtest-2

regards

Juerg Hutter
--------------------------------------------------------------
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
---------------------------------------------------------------

-----cp... at googlegroups.com wrote: -----To: cp... at googlegroups.com
From: Rizwan Nabi 
Sent by: cp... at googlegroups.com
Date: 06/18/2015 08:57AM
Subject: [CP2K:6673] BASIS SET GENERATION

Hi dear CP2K users and developers.
I want to generate GTH_BASIS_SET for lanthanide metals, I just want to know where to start with and how to start with?

Your help will be cordially appreciated.


Regards 
Rizwan



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