Large-Scale Benchmarking of Multireference Vertical-Excitation Calculations via Automated Active-Space Selection
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Title
Large-Scale Benchmarking of Multireference Vertical-Excitation Calculations via Automated Active-Space Selection
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 18, Issue 10, Pages 6065-6076
Publisher
American Chemical Society (ACS)
Online
2022-09-16
DOI
10.1021/acs.jctc.2c00630
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