On 16/05/2024 21:39, Nupur Mehra wrote:
I'm trying to perform a DFPT calculation using the SCAN functional. I
tried to do it using the QE version 6.4.1 first but I ran into the issue
about the phonon code with meta-GGA functionals not being available.
they aren't yet, and I doubt they are going to be available any time soon
I was suggested to use another version of QE (5.1.1) to do this calculation.
bad advice
Paolo
--
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216
AVAILABLE POSITION:
https://physicslab.uniud.it/persone/paolo-giannozzi/prin2022
_______________________________________________
The Quantum ESPRESSO community stands by the Ukrainian
people and expresses its concerns about the devastating
effects that the Russian military offensive has on their
country and on the free and peaceful scientific, cultural,
and economic cooperation amongst peoples
_______________________________________________
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users
