Royal Society of Chemistry, Physical Chemistry Chemical Physics, 29(22), p. 16804-16812, 2020
DOI: 10.1039/d0cp02947e
Full text: Unavailable
VXC(M,O): the exchange–correlation metric quantifies covalency between M and O atomic basins in M(OC6H5)4 (M = Ti, Zr, Hf, Ce, Th, Pa, U, Np).