Dear Developers,
in the PWSCF code v.6.1 the possibility to relax cell parameters (vc-relax)
together with van der Waals functional, input_dft=' vdW-DF2’
for magnetic systems (nspin=2) is not implemented. While this option is highly
desirable for my research, I would kindly ask You if You are going to include
this possibility in the future version?
Many thanks in advance,
Bogdan Yavorskyy.
_______________________________________________
Pw_forum mailing list
[email protected]
http://pwscf.org/mailman/listinfo/pw_forum