Arsenic Basis set and psuedopotentials data GTH + PADE
vshar... at doonuniversity.ac.in
Tue Apr 17 17:56:21 UTC 2018
thanks for helping out.
it meant a lot to me.
On Tuesday, April 17, 2018 at 11:18:15 PM UTC+5:30, Matt W wrote:
> You can find MOLOPT type basis sets in BASIS_MOLOPT and BASIS_MOLOPT_UCL
> and pseudopotentials in GTH_POTENTIALS. Both are in the data directory of
> the standard distribution.
> On Tuesday, April 17, 2018 at 6:40:08 PM UTC+1, Vikas Sharma wrote:
>> Looking for the basis set and pp data (GTH + PADE) for simulations in
>> kindly help with where/how to find them.
>> thanks in advance.
>> Dr, Vikas Sharma, Dehradun, India.
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