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Issue Date
Title
Author(s)
1-Jan-2019
Effects of π-expansion, an additional hydroxyl group, and substitution on the excited state single and double proton transfer of 2-hydroxybenzaldehyde and its relative compounds: TD-DFT static and dynamic study
Chanatkran Prommin
;
Khanittha Kerdpol
;
Tinnakorn Saelee
;
Nawee Kungwan
16-Jan-2019
Cavity closure of 2-hydroxypropyl-β-cyclodextrin: Replica exchange molecular dynamics simulations
Khanittha Kerdpol
;
Jintawee Kicuntod
;
Peter Wolschann
;
Seiji Mori
;
Chompoonut Rungnim
;
Manaschai Kunaseth
;
Hisashi Okumura
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
15-Jul-2019
Excited-state intramolecular proton transfer reactions of 2,5-bis(2′-benzoxazolyl)hydroquinone and its water cluster exhibiting single and double proton transfer: A TD-DFT dynamics simulation
Rathawat Daengngern
;
Rusrina Salaeh
;
Tinnakorn Saelee
;
Khanittha Kerdpol
;
Nawee Kungwan
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Author
2
Tinnakorn Saelee
1
Chanatkran Prommin
1
Chompoonut Rungnim
1
Hisashi Okumura
1
Jintawee Kicuntod
1
Manaschai Kunaseth
1
Peter Wolschann
1
Rathawat Daengngern
1
Rusrina Salaeh
1
Seiji Mori
.
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Chemical Engineering
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Physics and Astronomy