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Browsing by Author Nawee Kungwan

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Issue DateTitleAuthor(s)
1-Jun-2015Effects of alkoxide alteration on the ring-opening polymerization of ε-caprolactone initiated by n-Bu<inf>3</inf>SnOR: A DFT studyChanchai Sattayanon; Watit Sontising; Wanich Limwanich; Puttinan Meepowpan; Winita Punyodom; Nawee Kungwan
1-Jan-2017Effects of different proton donor and acceptor groups on excited-state intramolecular proton transfers of amino-type and hydroxy-type hydrogen-bonding molecules: Theoretical insightsNarissa Kanlayakan; Khanittha Kerdpol; Chanatkran Prommin; Rusrina Salaeh; Warinthon Chansen; Chanchai Sattayanon; Nawee Kungwan
1-Jan-2014Effects of the second hydration shell on excited-state multiple proton transfer: Dynamics simulations of 7-azaindole: (h<inf>2</inf>o)<inf>1-5</inf> clusters in the gas phaseNawee Kungwan; Khanittha Kerdpol; Rathawat Daengngern; Supa Hannongbua; Mario Barbatti
1-Jan-2019Effects 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 studyChanatkran Prommin; Khanittha Kerdpol; Tinnakorn Saelee; Nawee Kungwan
1-Jan-2016Electroanalytical application of screen-printed carbon electrode modified with conductive graphene oxide-poly(acrylic acid) film for label-free detection of human immunoglobulin GPoachanee Norfun; Watthanachai Jumpathong; Nawee Kungwan; Jaroon Jakmunee; Kontad Ounnunkad
3-May-2017Electrochemical Detection of Human Interleukin-15 using a Graphene Oxide-Modified Screen-Printed Carbon ElectrodePoachanee Norfun; Nuttee Suree; Nawee Kungwan; Winita Punyodom; Jaroon Jakmunee; Kontad Ounnunkad
10-Jul-2015Electronic and photophysical properties of 2-(2′-hydroxyphenyl)benzoxazole and its derivatives enhancing in the excited-state intramolecular proton transfer processes: A TD-DFT study on substitution effectRathawat Daengngern; Nawee Kungwan
15-Aug-2019Encapsulation of alpha-mangostin and hydrophilic beta-cyclodextrins revealed by all-atom molecular dynamics simulationsWiparat Hotarat; Sarunya Phunpee; Chompoonut Rungnim; Peter Wolschann; Nawee Kungwan; Uracha Ruktanonchai; Thanyada Rungrotmongkol; Supot Hannongbua
15-Jul-2017Ethylene insertion in the presence of new alkoxysilane electron donors for Ziegler-Natta catalyzed polyethyleneSutiam Kruawan; Manussada Ratanasak; Rungroj Chanajaree; Thanyada Rungrotmongkol; Oraphan Saengsawang; Vudhichai Parasuk; Nawee Kungwan; Supot Hannongbua
9-Dec-2021Exceptional electron conduction in two-dimensional covalent organic frameworksEnquan Jin; Keyu Geng; Shuai Fu; Sheng Yang; Narissa Kanlayakan; Matthew A. Addicoat; Nawee Kungwan; Johannes Geurs; Hong Xu; Mischa Bonn; Hai I. Wang; Jurgen Smet; Tim Kowalczyk; Donglin Jiang
15-Dec-2011Excited-state intermolecular proton transfer reactions of 7-azaindole(MeOH)<inf>n</inf>(n = 1-3) clusters in the gas phase: On-the-fly dynamics simulationRathawat Daengngern; Nawee Kungwan; Peter Wolschann; Adélia J.A. Aquino; Hans Lischka; Mario Barbatti
15-Jul-2019Excited-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 simulationRathawat Daengngern; Rusrina Salaeh; Tinnakorn Saelee; Khanittha Kerdpol; Nawee Kungwan
22-Sep-2015Excited-state proton-transfer reactions of 7-azaindole with water, ammonia and mixed water-ammonia: Microsolvated dynamics simulationKhanittha Kerdpol; Rathawat Daengngern; Nawee Kungwan
21-Dec-2020Formation of Excimers in Isoquinolinyl Pyrazolate Pt(II) Complexes: Role of Cooperativity EffectsChattarika Sukpattanacharoen; Prashant Kumar; Yun Chi; Nawee Kungwan; Daniel Escudero
1-Jan-2018Glycan binding and specificity of viral influenza neuraminidases by classical molecular dynamics and replica exchange molecular dynamics simulationsJiraphorn Phanich; Siraphob Threeracheep; Nawee Kungwan; Thanyada Rungrotmongkol; Supot Hannongbua
1-Aug-2017Heteroatom effect on photophysical properties of 2-(2′-hydroxyphenyl)benzimidazole and its derivatives as fluorescent dyes: A TD-DFT studyNatthaporn Manojai; Rathawat Daengngern; Khanittha Kerdpol; Chanisorn Ngaojampa; Nawee Kungwan
5-Nov-2019Heteroatom substitution effect on electronic structures, photophysical properties, and excited-state intramolecular proton transfer processes of 3-hydroxyflavone and its analogues: A TD-DFT studyChattarika Sukpattanacharoen; Rusrina Salaeh; Vinich Promarak; Daniel Escudero; Nawee Kungwan
1-Apr-2016How strong is the edge effect in the adsorption of anticancer drugs on a graphene cluster?Chompoonut Rungnim; Rungroj Chanajaree; Thanyada Rungrotmongkol; Supot Hannongbua; Nawee Kungwan; Peter Wolschann; Alfred Karpfen; Vudhichai Parasuk
1-Jan-2018Hydrogen storage performance of platinum supported carbon nanohorns: A DFT study of reaction mechanisms, thermodynamics, and kineticsChompoonut Rungnim; Kajornsak Faungnawakij; Noriaki Sano; Nawee Kungwan; Supawadee Namuangruk
15-Jul-2022Hydroxy-Tetraphenylimidazole Derivatives as Efficient Blue Emissive Materials for Electroluminescent DevicesWan Li; Pongsakorn Chasing; Phattananawee Nalaoh; Thanyarat Chawanpunyawat; Chattarika Sukpattanacharoen; Nawee Kungwan; Taweesak Sudyoadsuk; Vinich Promarak
Showing results 41 to 60 of 157 < previous   next >