non-relativistically generated PAW
Posted: Sat Jun 16, 2012 8:21 pm
Dear admin and users,
Now, I am doing a calculation using "PAW_PBE Au 06SEP2000". As I know, all PAW potentials were generated relativistically. Is it possible to get non-relativistically generated PAW for gold?
With best wishes,
JJ
Now, I am doing a calculation using "PAW_PBE Au 06SEP2000". As I know, all PAW potentials were generated relativistically. Is it possible to get non-relativistically generated PAW for gold?
With best wishes,
JJ