PBE functional

Queries about input and output files, running specific calculations, etc.


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adelvitt
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PBE functional

#1 Post by adelvitt » Wed Mar 16, 2005 12:04 pm

this is not proper a 'physics question', but anyway....do exist US pseudopotentials with PBE functionals or just PAW-PBE?
thanks
Last edited by adelvitt on Wed Mar 16, 2005 12:04 pm, edited 1 time in total.

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PBE functional

#2 Post by admin » Mon Apr 11, 2005 1:37 pm

for Perdew-Becke-Ernzerhof PPs, only PAW potentials were generated
Last edited by admin on Mon Apr 11, 2005 1:37 pm, edited 1 time in total.

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