화학공학소재연구정보센터
검색결과 : 17건
No. Article
1 Solvation structure and dynamics of K+ in aqueous ammonia solution: Insights from an ONIOM-XS MD simulation
Kabbalee P, Sripa P, Tongraar A, Kerdcharoen T
Chemical Physics Letters, 633, 152, 2015
2 "Structure-Making" Ability of Na+ in Dilute Aqueous Solution: An ONIOM-XS MD Simulation Study
Sripa P, Tongraar A, Kerdcharoen T
Journal of Physical Chemistry A, 117(8), 1826, 2013
3 Effects of surface concentration on the porphine monolayers: Molecular simulations at the nanoscale water-gas interface
Krongsuk S, Kerdcharoen T
Applied Surface Science, 257(14), 6270, 2011
4 Hydration structure and dynamics of K+ and Ca2+ in aqueous solution: Comparison of conventional QM/MM and ONIOM-XS MD simulations
Wanprakhon S, Tongraar A, Kerdcharoen T
Chemical Physics Letters, 517(4-6), 171, 2011
5 Effects of Chain Conformation and Chain Length on Degree of Aggregation in Assembled Particles of Conjugated Polymer in Solvents-Nonsolvent: A Spectroscopic Study
Traiphol R, Potai R, Charoenthai N, Srikhirin T, Kerdcharoen T, Osotchan T
Journal of Polymer Science Part B: Polymer Physics, 48(8), 894, 2010
6 Effects of Steric Anthracene Moieties and Keto Defects on Photophysics and Color Stability of Poly(9,9-di(2-ethylhexyl)fluorene-stat-anthracene) in Different Local Environments
Traiphol R, Pattanatornchai T, Srikhirin T, Kerdcharoen T, Osotchan T
Macromolecular Research, 18(12), 1182, 2010
7 The geometrical and electronic structures of open-end fully functionalized single-walled carbon nanotubes
Wongchoosuk C, Udomvech A, Kerdcharoen T
Current Applied Physics, 9(2), 352, 2009
8 Simulations of liquid ammonia based on the combined quantum mechanical/molecular mechanical (QM/MM) approach
Tongraar A, Kerdcharoen T, Hannongbua S
Journal of Physical Chemistry A, 110(14), 4924, 2006
9 Spectroscopic study of photophysical change in collapsed coils of conjugated polymers: Effects of solvent and temperature
Traiphol R, Sanguansat P, Srikhirin T, Kerdcharoen T, Osotchan T
Macromolecules, 39(3), 1165, 2006
10 First principles study of Li and Li+ adsorbed on carbon nanotube: Variation of tubule diameter and length
Udomvech A, Kerdcharoen T, Osotchan T
Chemical Physics Letters, 406(1-3), 161, 2005