Coupling Constants, High Spin, and Broken Symmetry States of Organic Radicals: an Assessment of the Molecules-in-Molecules Fragmentation-Based Method
Sadhukhan, Tumpa, Beckett, Daniel, Thapa, Bishnu, Raghavachari, KrishnanLanguage:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.9b00563
Date:
October, 2019
File:
PDF, 2.17 MB
english, 2019