[Pw_forum] Input file for NaCl molecule in Quantum espresso

[Saisudhakar]

Hi,

I am new to Quantum espresso program. I want to calculate the band
structure calculation for NaCl molecule. Please let me know how to generate
input file for it.


Thanking you
Saisudhakar
BITS-Pilani Hyderabad Campus
India-500078
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20150316/b49853e8/attachment.html>