Selenium substitution effects on excited-state properties and photophysics of uracil: a MS-CASPT2 study-Reference-Cited by-同舟云学术

Selenium substitution effects on excited-state properties and photophysics of uracil: a MS-CASPT2 study

Author:

Peng Qin¹²³⁴,Zhu Yun-Hua¹²³⁴,Zhang Teng-Shuo¹²³⁴,Liu Xiang-Yang⁵⁶⁷⁴,Fang Wei-Hai¹²³⁴,Cui Ganglong¹²³⁴^ORCID

Affiliation:

1. Key Laboratory of Theoretical and Computational Photochemistry, Ministry of Education, College of Chemistry

2. Beijing Normal University

3. Beijing 100875

4. China

5. College of Chemistry and Materials Science

6. Sichuan Normal University

7. Chengdu 610068

Abstract

We have employed the MS-CASPT2 approach to explore selenium substitution effects on the excited state properties and photophysics of uracil.

Funder

National Natural Science Foundation of China

Fundamental Research Funds for the Central Universities

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

Reference87 articles.

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