3 ms·
Can they do dft+u/strong-ish correlations?
by ivalm 4y ago
Can they do dft+u/strong-ish correlations?
- chazeon 4y agoI know people are exploring this front currently. Basically you could use results from DFT+U to train the potential; but I am also told that strongly correlation can now be better described by SCAN functionals better than LDA+U etc so it would be even easier then.