Dear Subrata AFAIK It is not possible to generate meta-GGA pseudo potentials with atomic yet. Best Giuseppe
Subrata Jana <subrata.j...@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.matti...@ism.cnr.it> _______________________________________________ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum