TY  - RPRT
TI  - Zero-Field Splitting Calculations by Multiconfiguration Pair-Density Functional Theory
AU  - Wu, Dihua
AU  - Zhou, Chen
AU  - Bao, Jie J.
AU  - Gagliardi, Laura
AU  - Truhlar, Donald G.
PY  - 2022
DO  - 10.1021/acs.jctc.1c01115
UR  - https://www.osti.gov/biblio/1875663
ID  - 1875663
ER  -