Re: [Wien] Hybrid funtional

Thank you very much 2017-06-11 8:43 GMT+02:00 : > LDA+U, onsite hybrid, and full hybrid are all supposed to be > better than normal LDA/GGA for correlated systems. > It would not really make sense to mix them together. > > On Sunday 2017-06-11 04:33, karima Physique

Re: [Wien] Hybrid funtional

LDA+U, onsite hybrid, and full hybrid are all supposed to be better than normal LDA/GGA for correlated systems. It would not really make sense to mix them together. On Sunday 2017-06-11 04:33, karima Physique wrote: Date: Sun, 11 Jun 2017 04:33:38 From: karima Physique