new functional of the" Tran-Blaha"

mohamed khuili khuili... at gmail.com
Tue Jun 17 11:17:51 UTC 2014


Thank M.hutter for your reply
I tried, but it gives me the following error message:

 *************************************************
 *** ERROR in libxc_lda_info (MODULE xc_libxc) ***
 *************************************************

 *** XC_MGGA_X_TB09: desactivated since (probably) buggy in v2.0.1 of libxc 
***

 *** Program stopped at line number 125 of MODULE xc_libxc ***

how I can solve it ?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20140617/760d88ee/attachment.htm>


More information about the CP2K-user mailing list