Theoretical Calculation of Core-Excited States along Dissociative Pathways beyond Second-Order Perturbation Theory-Reference-Cited by-同舟云学术

Theoretical Calculation of Core-Excited States along Dissociative Pathways beyond Second-Order Perturbation Theory

Published:2021-12-29 Issue:1 Volume:18 Page:219-233
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Huang Meng¹^ORCID,Li Chenyang¹²^ORCID,Evangelista Francesco A.¹^ORCID

Affiliation:

1. Department of Chemistry and Cherry Emerson Center for Scientific Computation, Emory University, Atlanta, Georgia 30322, United States

2. Key Laboratory of Theoretical and Computational Photochemistry, Ministry of Education, College of Chemistry, Beijing Normal University, Beijing 100875, China

Funder

Division of Chemistry

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.1c00884

Reference130 articles.

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4. Femtosecond x-ray spectroscopy of an electrocyclic ring-opening reaction

5. Observation of the fastest chemical processes in the radiolysis of water

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