That is also my question. It seems that no one is going to help. On Mon, Aug 8, 2016 at 11:49 AM, Riya Rogers <[email protected]> wrote:
> Dear all > > If I am using GGA PBE and I used psedopotentials from siesta site. > > Should I generate or is it ok to proceed with it? > > Please clarify... > > Thanks > > On 04-Aug-2016 9:56 pm, "gagandeep Kaur" <[email protected]> wrote: > >> Thanks sir..bt wat abt .psf files?? >> >> >> Sent from Samsung Mobile >> >> >> -------- Original message -------- >> From: Seyed Mohammad Tabatabaei >> Date:04/08/2016 6:49 PM (GMT+05:30) >> To: [email protected] >> Subject: Re: [SIESTA-L] VDW Calculations >> >> Hi, >> >> I think you should set the following flags in your fdf file: >> >> XC.Functional VDW >> XC.authors DRSLL >> >> Bests, >> Mohammad, >> >
