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Open Physics
(Jun 2011)
Excited-state hydrogen bonding dynamics of methyl isocyanide in methanol solvent: A DFT/TDDFT study
Wang Hongfei,
Wang Meishan,
Xin Mingliang,
Liu Enfu,
Yang Chuanlu
Affiliations
Wang Hongfei
School of Physics, Ludong University, Yantai, 264025, China
Wang Meishan
School of Physics, Ludong University, Yantai, 264025, China
Xin Mingliang
College of Mechanical and Electronic Engineering, Hebei University of Science and Technology, Shijiazhuang, 050054, China
Liu Enfu
College of Mechanical and Electronic Engineering, Hebei University of Science and Technology, Shijiazhuang, 050054, China
Yang Chuanlu
School of Physics, Ludong University, Yantai, 264025, China
DOI
https://doi.org/10.2478/s11534-010-0099-4
Journal volume & issue
Vol. 9, no. 3
pp. 792 – 799
Abstract
Read online
No abstracts available.
Keywords
hydrogen bond
excited state
spectral redshift
spectral blue-shift
orbital transition
electronic transition
strengthening
weakening
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