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Core Binding Energy Calculations: A Scalable Approach with the Quantum Embedding-Based Equation-of-Motion Coupled-Cluster Method.

Authors :
Jangid, Bhavnesh
Hermes, Matthew R.
Gagliardi, Laura
Source :
Journal of Physical Chemistry Letters; 6/6/2024, Vol. 15 Issue 22, p5954-5963, 10p
Publication Year :
2024

Details

Language :
English
ISSN :
19487185
Volume :
15
Issue :
22
Database :
Supplemental Index
Journal :
Journal of Physical Chemistry Letters
Publication Type :
Academic Journal
Accession number :
177776610
Full Text :
https://doi.org/10.1021/acs.jpclett.4c00957