Energy-Specific Equation-of-Motion Coupled-Cluster Methods for High-Energy Excited States: Application to K-edge X-ray Absorption Spectroscopy
Author:
Affiliation:
1. Department of Chemistry, University of Washington, Seattle, Washington 98195, United States
2. Department of Chemistry, University of Kansas, Lawrence, Kansas 66045, United States
Funder
University of Washington
Division of Graduate Education
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00459
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4. A Systematic K-edge X-ray Absorption Spectroscopic Study of Cu(III) Sites
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