[CP2K-user] How to make cell

sumit agrawal sumitag... at gmail.com
Mon Aug 10 12:39:56 UTC 2020


Hi everyone,

I am new to molecular dynamics simulations. I want to simulate methanol in
water solvent at different temperatures starting from 10k to 100K. How can
I simulate this using CP2K?

Please help me out!!
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20200810/eba5b8bc/attachment.htm>


More information about the CP2K-user mailing list