[gpaw-users] QP WAVEFUNCTIONS

[Kristian Sommer Thygesen]

Dear Martin

No, none of these are possible at present. But sounds like interesting projects ;-)

Best regards
Kristian

Sent from my iPhone

On 31/03/2015, at 07.59, "Martin Spenke" <martinspenke at yahoo.de<mailto:martinspenke at yahoo.de>> wrote:

Dear all,

1) Is it in GPAW possible to build up the BSE matrix using the calculated quasi particle wave functions instead of the KS-WFs? If yes, How ?
2) Is a dynamical BSE kernel in GPAW available or will be available to tackle the issue of double excitations for molecular systems ?

Bests
Martin
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