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

Peng, Q; Zhu, YH; Zhang, TS; Liu, XY; Fang, WH; Cui, GL

Cui, GL (corresponding author), Beijing Normal Univ, Coll Chem, Key Lab Theoret & Computat Photochem, Minist Educ, Beijing 100875, Peoples R China.; Liu, XY (corresponding author), Sichuan Normal Univ, Coll Chem & Mat Sci, Chengdu 610068, Peoples R China.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2020; 22 (21): 12120

Abstract

The photophysics of selenium-substituted nucleobases has attracted recent experimental attention because they could serve as potential photosensitizer......

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