Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
What Levels of Coupled Cluster Theory Are Appropriate for Transition Metal Systems? a Study Using near Exact Quantum Chemical Values for 3d Transition Metal Binary Compounds.
, Authors:
Diptarka Hait, Norman Tubman, Daniel Levine, K. Birgitta Whaley, Martin Head-Gordon
Version 2 posted 22 August 2019
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