[CP2K-user] [CP2K:17534] CPASSERT failed, force_env_types.F:188 error

jerryt...@gmail.com jerrytanoury at gmail.com
Tue Aug 23 18:55:42 UTC 2022


Dear Forum,
I have built the latest release version of CP2k (2022.1) using the 
toolchain, GNU 8.4.0, MKL 2021.3 and using the following options:
CP2K_TOOLCHAIN_OPTIONS="-j 8 --with-gcc=system --with-cmake 
--with-mkl=system --enable-cuda --gpu-ver=V100 --no-check-certificate 
--with-elpa=no --with-sirius=no --with-spla=no"

When I run the input file attached below, I get a CPASSERT error shown in 
the cp2k.out file.  Is there a way to fix this?

Thank you for your help,
Jerry

-- 
You received this message because you are subscribed to the Google Groups "cp2k" group.
To unsubscribe from this group and stop receiving emails from it, send an email to cp2k+unsubscribe at googlegroups.com.
To view this discussion on the web visit https://groups.google.com/d/msgid/cp2k/6617bbb6-91fe-4787-96a4-9cd09b3c8268n%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220823/c12ca663/attachment-0001.htm>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: TEST_1.inp
Type: chemical/x-gamess-input
Size: 2654 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220823/c12ca663/attachment-0001.inp>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: cp2k.output
Type: application/octet-stream
Size: 8998 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220823/c12ca663/attachment-0001.obj>


More information about the CP2K-user mailing list