Skip to Content.
Sympa Menu

forum - Re: [abinit-forum] Third line for fhi pseudos

forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

Re: [abinit-forum] Third line for fhi pseudos


Chronological Thread 
  • From: verstraete@pcpm.ucl.ac.be
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Third line for fhi pseudos
  • Date: Fri, 31 Jan 2003 13:44:34 +0100 (CET)

enter 1. The value is just a flag.

Matthieu


On Fri, 31 Jan 2003, Thomas Maxisch wrote:

> Hello,
>
> I have a little problem with fhi pseudopotentials which are generated with
> core corrections.
> following the psp6.info file, I took the rchrg value to a reasonable one.
> But what have I to chose for frchrg. I do not understand the comment in
> psp6.info.
>
> Can anybody give me a hint?
>
> Thanks a lot,
> Thomas
>
>
>

--
===================================================================
Matthieu Verstraete mailto:verstraete@pcpm.ucl.ac.be
PCPM, Boltzmann, pl. Croix du Sud, 1 tel: 010/ 47 86 81
B-1348 Louvain-la-Neuve Belgium fax: 010/ 47 34 52




Archive powered by MHonArc 2.6.16.

Top of Page