Hi to all,
I am trying to generate the pseudo potential of Sm and S. I am not able to
define the last line of pseudo potential input file [rc(s) rc(p) rc(d) rc(f)
rcore_flag rcore.]
If this data is fixed then from where I can collect this data?
Regards,
Nidhi
Yurko Natanzon [EMAIL
Dear Andrei,
On 13/03/2008, at 20:36, Andrei Postnikov wrote:
Many thanks for Eduardo Anglada for uploading the ABINIT pseudos!
Just two related questions:
1. Does somebody know whether there s a way to see from the .psf
file if the core correction is included, and with which radius?
On 13/03/2008, at 20:36, Andrei Postnikov wrote:
| 1. Does somebody know whether there s a way to see from the .psf file if the
| core correction is included, and with which radius?
|
On Fri, 14 Mar 2008, Eduardo Anglada wrote:
| Just now there is no way, but I have all the info, of course
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