Off-Diagonal Self-Energy Terms and Partially Self-Consistency in GW Calculations for Single Molecules: Efficient Implementation and Quantitative Effects on Ionization Potentials

Title
Off-Diagonal Self-Energy Terms and Partially Self-Consistency in GW Calculations for Single Molecules: Efficient Implementation and Quantitative Effects on Ionization Potentials
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 11, Issue 11, Pages 5152-5160
Publisher
American Chemical Society (ACS)
Online
2015-10-14
DOI
10.1021/acs.jctc.5b00394

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