[CP2K:5882] basis set generation

Ari Paavo Seitsonen ari.p.s... at gmail.com
Fri Nov 21 08:08:21 UTC 2014

Dear Satya(?),

  http://cp2k.berlios.de/ was the old site hosting the pages on CP2K: the
new site is the http://www.CP2K.org/ . I cannot guarantee, however, that
the content you are looking for is there, but it is the best place to start
looking for. Otherwise hopefully some one else, more experienced person on
this forum, will answer.

    Greetings from Montrouge,


2014-11-21 7:22 GMT+01:00 satya <satyanaray... at gmail.com>:

> Dear CP2K users,
> I want to perform optimization calculations of periodic system contains
> the Tb atom using CP2K-2.4.0. The psuedopotential corresponds to LDA
> exchange correlation function has gotten for Tb atom from
> http://cp2k.web.psi.ch/potentials/ website. Whereas, the basis set for Tb
> is not available in tests/QS/BASIS_MOLOPT directory. I have gone through
> cp2k mailing list where people suggested to generate basis set from
> http://cp2k.berlios.de/ website. Here, we do not have an access for this
> website. Can anyone please suggest, is there any alternative way to
> generate basis set manually for cp2k.  Your help would be greatly
> appreciated.
> Thanks in advance.
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  Ari Paavo Seitsonen / Ari.P.S... at iki.fi / http://www.iki.fi/~apsi/
  Institut für Chemie der Universität Zürich
  Tel: +41 44 63 55 44 97  /  Mobile: +41 79 71 90 935
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