Energy-Specific Equation-of-Motion Coupled-Cluster Methods...

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Journal of Chemical Theory and Computation 2015 / 08

Energy-Specific Equation-of-Motion Coupled-Cluster Methods for High-Energy Excited States: Application to K -edge X-ray Absorption Spectroscopy

Peng, Bo, Lestrange, Patrick J., Goings, Joshua J., Caricato, Marco, Li, Xiaosong
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Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.5b00459
Date:
August, 2015
File:
PDF, 700 KB
english, 2015
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