spherical basis set causes segmentation violation error?
Click here for full thread
Forum Regular
3:52:32 PM PDT - Wed, Apr 16th 2014
Hi Dongxia,
I have just checked a fix in for this problem. Please follow the instructions below to patch your code.
1) cd $NWCHEM_TOP/src
2) cd NWints/texas
3) wget
http://nwchemgit.github.io/images/Spherical_segfault.patch.gz
4) gunzip Spherical_segfault.patch.gz
5) patch -p0 < Spherical_segfault.patch
Huub