A 3‐D bonding perspective of the factors influencing the relative stability of the S1/S0conical intersections of the penta‐2,4‐dieniminium cation (PSB3)-Reference-Cited by-同舟云学术

A 3‐D bonding perspective of the factors influencing the relative stability of the S1/S0conical intersections of the penta‐2,4‐dieniminium cation (PSB3)

Published:2019-01-14 Issue:11 Volume:119 Page:e25903
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int J Quantum Chem

Author:

Bin Xin¹²,Momen Roya¹²,Xu Tianlv¹²,Kirk Steven R.¹²^ORCID,Filatov Michael¹²³,Jenkins Samantha¹²^ORCID

Affiliation:

1. Key Laboratory of Chemical Biology and Traditional Chinese Medicine Research, College of Chemistry and Chemical EngineeringHunan Normal University Changsha Hunan China

2. Key Laboratory of Resource Fine‐Processing and Advanced Materials of Hunan Province of MOE, College of Chemistry and Chemical EngineeringHunan Normal University Changsha Hunan China

3. Department of ChemistryUlsan National Institute of Science and Technology (UNIST) 50 UNIST‐gil, Ulsan Korea

Funder

National Natural Science Foundation of China

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/qua.25903

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4. Quantum Monte Carlo Treatment of the Charge Transfer and Diradical Electronic Character in a Retinal Chromophore Minimal Model

5. The C5H6NH2+ Protonated Shiff Base: An ab Initio Minimal Model for Retinal Photoisomerization

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