upward

Multiconfiguration DFT

Y Lu, R Zhao, J Zhang, M Liu, J Gao, Minimal Active Space: NOSCF and NOSI in Multistate Density Functional Theory, JCTC 18, 6407 (2022)

P Sharma, J Bao, D Truhlar, L Gagliardi, Multiconfiguration Pair-Density Functional Theory, ARPC 72, 541 (2021) – doi

L Gagliardi, D G Truhlar, G L Manni, R K Carlson, C E Hoyer, J L Bao, Multiconfiguration Pair-Density Functional Theory: A New Way To Treat Strongly Correlated Systems, ACR 50, 66 (2017)