Excited State Intramolecular Proton Transfer in Methyl and Methoxy Substituted Salicylic Acid

2009 ◽  
Vol 27 (10) ◽  
pp. 1897-1902 ◽  
Author(s):  
Kumar Sahoo Suban ◽  
Kanta Bera Rati ◽  
Kishore Kanungo Bikram ◽  
Baral Minati
Keyword(s):  
Salicylic Acid ◽  
Excited State ◽  
Proton Transfer ◽  
Intramolecular Proton Transfer

Ground and Excited State Intramolecular Proton Transfer in Salicylic Acid:  an Ab Initio Electronic Structure Investigation

1999 ◽  
Vol 103 (31) ◽  
pp. 6257-6262 ◽  
Author(s):  
Shruti Maheshwari ◽  
Arindam Chowdhury ◽  
Narayanasami Sathyamurthy ◽  
Hirdyesh Mishra ◽  
H. B. Tripathi ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Salicylic Acid ◽  
Excited State ◽  
Proton Transfer ◽  
Ab Initio ◽  
Intramolecular Proton Transfer ◽  
Structure Investigation ◽  
Ab Initio Electronic Structure

scholarly journals An enhanced sampling QM/AMOEBA approach: The case of the excited state intramolecular proton transfer in solvated 3-hydroxyflavone

2021 ◽  
Vol 154 (18) ◽  
pp. 184107
Author(s):  
Michele Nottoli ◽  
Mattia Bondanza ◽  
Filippo Lipparini ◽  
Benedetta Mennucci
Keyword(s):  
Excited State ◽  
Proton Transfer ◽  
Intramolecular Proton Transfer ◽  
Enhanced Sampling
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