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.

Excited state proton transfer and photochromism of an aromatic Schiff base. Pico- and femtosecond kinetics of the N,N′-bis(salicylidene)-p-phenylenediamine (BSP)

2003 ◽  
Vol 369 (1-2) ◽  
pp. 80-89 ◽  
Author(s):  
Marcin Ziółek ◽  
Jacek Kubicki ◽  
Andrzej Maciejewski ◽  
Ryszard Naskrȩcki ◽  
Anna Grabowska
Keyword(s):  
Schiff Base ◽  
Excited State ◽  
Proton Transfer ◽  
Excited State Proton Transfer ◽  
Kinetics Of

Excited state proton transfer (ESIPT) based molecular probe to sense F− and CN− anions through a fluorescence “turn-on” response

2018 ◽  
Vol 42 (14) ◽  
pp. 11746-11754 ◽  
Author(s):  
Rashid Ali ◽  
Ramesh C. Gupta ◽  
Sushil K. Dwivedi ◽  
Arvind Misra
Keyword(s):  
Schiff Base ◽  
Excited State ◽  
Proton Transfer ◽  
Molecular Probe ◽  
Anion Sensing ◽  
Turn On ◽  
Excited State Proton Transfer ◽  
Fluorescence Turn On

Dual anion sensing through an efficient thiazole based phenolic Schiff base containing molecular probe by means of fluorescence “turn-on” response.

The effect of protic solvents on the excited state proton transfer of 3-hydroxyflavone: A TD-DFT static and molecular dynamics study

2018 ◽  
Vol 252 ◽  
pp. 428-438 ◽  
Author(s):  
Rusrina Salaeh ◽  
Chanatkran Prommin ◽  
Warinthon Chansen ◽  
Khanittha Kerdpol ◽  
Rathawat Daengngern ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Excited State ◽  
Proton Transfer ◽  
Protic Solvents ◽  
Td Dft ◽  
Excited State Proton Transfer

The effect of hydrogen bonding on the excited-state proton transfer in 2-(2′-hydroxyphenyl)benzothiazole: a TDDFT molecular dynamics study

2012 ◽  
Vol 14 (25) ◽  
pp. 9016 ◽  
Author(s):  
Nawee Kungwan ◽  
Felix Plasser ◽  
Adélia J. A. Aquino ◽  
Mario Barbatti ◽  
Peter Wolschann ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Hydrogen Bonding ◽  
Excited State ◽  
Proton Transfer ◽  
Excited State Proton Transfer
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