Theoretical Study on the Substituent Effect on the Excited-State Proton Transfer in the 7-Azaindole-Water Derivatives

2017 ◽  
Vol 94 (1) ◽  
pp. 27-35 ◽  
Author(s):  
Jiacheng Yi ◽  
Hua Fang
Keyword(s):  
Excited State ◽  
Proton Transfer ◽  
Substituent Effect ◽  
Theoretical Study ◽  
Excited State Proton Transfer

scholarly journals Tailoring the Schiff base photoswitching – a non-adiabatic molecular dynamics study of substituent effect on excited state proton transfer

2017 ◽  
Vol 19 (7) ◽  
pp. 5318-5325 ◽  
Author(s):  
Joanna Jankowska ◽  
Mario Barbatti ◽  
Joanna Sadlej ◽  
Andrzej L. Sobolewski
Keyword(s):  
Molecular Dynamics ◽  
Schiff Base ◽  
Excited State ◽  
Proton Transfer ◽  
Substituent Effect ◽  
Transfer Efficiency ◽  
Excited State Proton Transfer

Dynamics reveals how to design chemical substitutions to control excited-state proton transfer efficiency.

A theoretical study of ground and excited state proton transfer and rotamerim in salicylanilide and its 1:1 complex with methanol

2010 ◽  
Vol 945 (1-3) ◽  
pp. 110-115 ◽  
Author(s):  
Ziyan Zhou ◽  
Guogang Shan ◽  
Yi Liao ◽  
Wei Xing ◽  
Shuangyang Yang ◽  
...  
Keyword(s):  
Excited State ◽  
Proton Transfer ◽  
Theoretical Study ◽  
Excited State Proton Transfer

Theoretical Study on the Size Dependence of Excited State Proton Transfer in 1-Naphthol–Ammonia Clusters

2014 ◽  
Vol 119 (6) ◽  
pp. 2415-2424 ◽  
Author(s):  
Toshihiko Shimizu ◽  
Shunpei Yoshikawa ◽  
Kenro Hashimoto ◽  
Mitsuhiko Miyazaki ◽  
Masaaki Fujii
Keyword(s):  
Excited State ◽  
Proton Transfer ◽  
Size Dependence ◽  
Theoretical Study ◽  
Excited State Proton Transfer ◽  
Ammonia Clusters
Sign in / Sign up

Export Citation Format

Share Document