including van der waals interaction into DFPT

Phonons, DFPT, electron-phonon, electric-field response, mechanical response…

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marsusi
Posts: 13
Joined: Sat Jul 06, 2013 10:22 am

including van der waals interaction into DFPT

Post by marsusi » Thu Aug 01, 2013 11:29 am

Dear users,

Can DFPT sources of abinit also calculate the effect of vdw interactions on phonon frequencies? Can one use for example ixc=-170 to compute electron-phonon interaction correctly and calculate the vdw effect on the the related matrix components?

Sincerely yours,

Marsusi.
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