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via Cozzi 53, 20125 Milano, Italy
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> But when we divide the unit cell into 2 parts
> and we use projwfc.x for calculation of local dos, the sum of two local
> dos columns is smaller than total dos.
You are probably using USPP and missing the augmentation charge
contribution.
> I will be very grateful ifyou can give me a suggestio
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> Guido Fratesi
>
> Dipartimento di Scienza dei Materiali
> Universita` degli Studi di Milano-Bicocca
> via Cozzi 53, 20125 Milano, Italy
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Guido Fratesi
Dipartimento di Scienza dei Materiali
Universita` degli Studi di Milano-Bicocca
via Cozzi 53, 20125 Milano, Italy
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o.baroni.me [+39] 040 3787 406 (tel) -528 (fax) / stefanobaroni
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