[Pw_forum] VdW for open shell systems

Giuseppe Mattioli giuseppe.mattioli at ism.cnr.it
Fri May 24 15:18:47 CEST 2013


Dear all
In the jungle of new dispersion corrected density functional (:-)) I was looking for an ab-initio functional supporting open shell (nspin=2) 
calculations. Does anybody have information on something new that I'm not aware of (and that is NOT the semiempirical DFTD2 correction), which is 
available in QE?
Thanks in advance

Giuseppe

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   Giuseppe Mattioli                            
   CNR - ISTITUTO DI STRUTTURA DELLA MATERIA   
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