Assessing the Performance of CASPT2 and DFT Methods for the Description of Long, Multicenter Bonding in Dimers between Radical Ions
Author:
Affiliation:
1. Departament de Química Física and IQTCUB, Facultat de Química, Universitat de Barcelona, Av. Diagonal 645, 08028 Barcelona, Spain
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct4010257
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