[Pw_forum] PAW orthonormality and obtaining S|psi>

Paolo Giannozzi p.giannozzi at gmail.com
Sat Apr 16 19:10:24 CEST 2016


On Sat, Apr 16, 2016 at 4:21 PM, Holzwarth, Natalie <natalie at wfu.edu> wrote:

Paolo Giannozzi programmed this into quantum espresso in version 5.3.0.
>

I don't deserve that much credit: you programmed it, I just adapted it to
v.5.3

Paolo

-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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