[Pw_forum] How to obtain the binding energy ( in the unit of eV/Zn-O pair ) for Wurtsite ZnO?
zhaohscas at yahoo.com.cn
Fri May 27 08:49:07 CEST 2011
I want to obtain the binding energy ( in the unit of eV/Zn-O pair ) for Wurtsite ZnO. Considering that there are two different length of Zn-O bond, I cann't figure out how to calculate the binding energy in the unit ev/ZnO. Any hints on this issue?
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the users