RI-MP2 basis set generation
labicia
lab... at yahoo.it
Thu Apr 24 09:30:27 UTC 2014
Good morning,
we are planning to perform some RI-MP2 computations.
We have found the RI basis sets only for a few elements:
in particular we need H, C, N, Zn.
Can anybody tell us how to generate them, or give us references
that explain the process.
Thank you in advance,
Marco and Andrea
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20140424/c81b3f8e/attachment.htm>
More information about the CP2K-user
mailing list