Calculate MSDs during MD run

Johannes Wagner joh... at gmail.com
Mon Aug 10 12:18:12 UTC 2015


Thank you Marcella,
it must have been an issue with my cp2k version.. I recompiled a new one 
and now it works flawlessly.. thank you very much!
kind regards,
Johannes
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20150810/e9ad01a7/attachment.htm>


More information about the CP2K-user mailing list