[SIESTA-L] Single point energy calculation within SIESTA.

[Hongyi Zhao]

Hi all,

I've learned that the single point energy calculation should be the
most appropriate method for any type of convergence testings (whether
that be k-point, cutoff, fine grid or cell size).  I want to know if 
there are keywords/flags within SIESTA for single point energy calculation?

Regards.
--
Hongyi Zhao <hongyi.z...@gmail.com>
Institute of Semiconductors, Chinese Academy of Sciences
GnuPG DSA: 0xD108493