화학공학소재연구정보센터
검색결과 : 9건
No. Article
1 Effect of the partial charge distributions in the ZIF-8 framework on the adsorption of CO2 as assessed by Gibbs Ensemble Monte Carlo simulations
Puphasuk P, Remsungnen T
Chemical Physics Letters, 647, 20, 2016
2 Diffusion of CH4 and H-2 in ZIF-8
Hertag L, Bux H, Caro J, Chmelik C, Remsungnen T, Knauth M, Fritzsche S
Journal of Membrane Science, 377(1-2), 36, 2011
3 The Permeation of Methane Molecules through Silicalite-1 Surfaces
Thompho S, Chanajaree R, Remsungnen T, Hannongbua S, Bopp PA, Fritzsche S
Journal of Physical Chemistry A, 113(10), 2004, 2009
4 Optimal binding site of a methane molecule on the silanol covered (010) surface of silicalite-1: ONIOM calculations
Remsungnen T, Kormilets V, Loisruangsin A, Schuring A, Fritzsche S, Haberlandt R, Hannongbua S
Journal of Physical Chemistry B, 110(24), 11932, 2006
5 Structure and energetics of water-silanol binding on the surface of silicalite-1: Quantum chemical calculations
Saengsawang O, Remsungnen T, Fritzsche S, Haberlandt R, Hannongbua S
Journal of Physical Chemistry B, 109(12), 5684, 2005
6 Molecular dynamics simulation of the hydration of transition metal ions: the role of non-additive effects in the hydration shells of Fe2+ and Fe3+ ions
Remsungnen T, Rode BM
Chemical Physics Letters, 385(5-6), 491, 2004
7 Solvation structure of glucosamine in aqueous solution as studied by Monte Carlo simulation using ab initio fitted potential
Siraleartmukul K, Siriwong K, Remsungnen T, Muangsin N, Udomkichdecha W, Hannongbua S
Chemical Physics Letters, 395(4-6), 233, 2004
8 Dynamical properties of the water molecules in the hydration shells of Fe(II) and Fe(III) ions: ab initio QM/MM molecular dynamics simulations
Remsungnen T, Rode BM
Chemical Physics Letters, 367(5-6), 586, 2003
9 QM/MM molecular dynamics simulation of the structure of hydrated Fe(II) and Fe(III) ions
Remsungnen T, Rode BM
Journal of Physical Chemistry A, 107(13), 2324, 2003