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

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...

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書目詳細資料
Main Authors:	Daengngern R., Kerdpol K., Kungwan N., Hannongbua S., Barbatti M.
格式:	Article
語言:	English
出版:	2014
在線閱讀:	http://www.scopus.com/inward/record.url?eid=2-s2.0-84879480060&partnerID=40&md5=bb39aad3e1467fe4b9fcab8b7d24285f http://cmuir.cmu.ac.th/handle/6653943832/7217
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