Re: Large difference between RIM and Real RL volume based on Random Integration Method
Posted: Tue May 21, 2024 10:49 am
Dear Youzhao,
in the meanwhile we inspect the problem you can go on with your calculation using
in your nscf input file.
In this way, the k point grid is recognised as uniform and the coulomb integrals are evaluated correctly.
Best,
Daniele
in the meanwhile we inspect the problem you can go on with your calculation using
Code: Select all
nosym=.true. In this way, the k point grid is recognised as uniform and the coulomb integrals are evaluated correctly.
Best,
Daniele