Frequency dependent dielectric constant calculation
bharat
bharats... at gmail.com
Fri Oct 31 12:12:51 UTC 2014
Hello Experts,
I am sorry for posting bit off topic here.
Does anyone know or have a post processing scripts to calculate frequency
dependent dielectric constant from dipole moment? Basically time
correlation function is calculated from total dipole moment of the system.
Thank you.
Bharat
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20141031/e875a56a/attachment.htm>
More information about the CP2K-user
mailing list