[Wien] Query from your JPCM paper
Jyoti
ms.jdani at rediffmail.com
Wed Dec 19 05:11:29 CET 2012
Dear Prof. Blaha,
I have a small question: in your paper in journal of physics:Condensed Matter , you have given a formula for calculation of Ewald Energy (Equation 4). For this, how do you choose Rmt with respect to Rws. Do you choose Rmt ~ Rws , for this.
If you have any reference to suggest for this, that also is ok. Thank you very much for your time and kind attention, Prof. Blaha.
Thanks,
Jyoti
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20121219/4a807261/attachment.htm>
More information about the Wien
mailing list