[Pw_forum] Fwd: generating PDOS is missing for some atoms
Sonu Kumar
1009ukumar at gmail.com
Tue Jul 29 12:02:55 CEST 2014
Tonatiuh,
>If the pseudo does not contain the wavefunctions, then it will not do the
PDOS.
Yes, you are right !!! PDOS calculation needs projection of KS-eigen
states on a set of
ortho-normal basis (atomic states are taken as an approx. orthonormal
basis)
.
Good Luck !!
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