[Pw_forum] SCAN + rVV10

[Giuseppe Mattioli]

Dear Subrata
AFAIK It is not possible to generate meta-GGA pseudo potentials with  
atomic yet.
Best
Giuseppe

Subrata Jana <subrata.jana at niser.ac.in> ha scritto:

> Dear users,
> I want to do some rVV10 dispersion corrected calculation using SCAN
> meta-GGA for my MoS2 bilayer. It is possible to generate pseudo potential
> for Mo and S for SCAN meta-GGA using atomic code that is inside the QE ? If
> yes then what is the procedure ?
>
> Regards,
> Subrata



GIUSEPPE MATTIOLI
CNR - ISTITUTO DI STRUTTURA DELLA MATERIA
Via Salaria Km 29,300 - C.P. 10
I-00015 - Monterotondo Scalo (RM)
Mob (*preferred*) +39 373 7305625
Tel + 39 06 90672342 - Fax +39 06 90672316
E-mail: <giuseppe.mattioli at ism.cnr.it>