Dynamics simulations of excited-state triple proton transfer in7-azaindole complexes with water, water-methanol and methanol

Excited-state triple proton transfer (ESTPT) reactions in 7-azaindole (7AI) complexed with two water,with one water and one methanol, and with two methanol molecules were investigated by dynamicssimulations in the first excited state computed with the second order algebraic-diagrammatic construc-tio...

Full description

Saved in:
Bibliographic Details
Main Authors: Rathawat Daengngern, Khanittha Kerdpol, Nawee Kungwan, Supa Hannongbua, Mario Barbatti
Format: Journal
Published: 2018
Online Access:https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=84879480060&origin=inward
http://cmuir.cmu.ac.th/jspui/handle/6653943832/48289
Tags: Add Tag
No Tags, Be the first to tag this record!
Institution: Chiang Mai University