화학공학소재연구정보센터
검색결과 : 14건
No. Article
1 Water-Methanol Mixtures: Simulations of Mixing Properties over the Entire Range of Mole Fractions
Soetens JC, Bopp PA
Journal of Physical Chemistry B, 119(27), 8593, 2015
2 Non-equilibrium molecular dynamics simulation of the thermocapillary effect
Maier HA, Bopp PA, Hampe MJ
Canadian Journal of Chemical Engineering, 90(4), 833, 2012
3 The vibrating hydroxide ion in water
Hermansson K, Bopp PA, Spangberg D, Pejov L, Bako I, Mitev PD
Chemical Physics Letters, 514(1-3), 1, 2011
4 MD simulations of the Soret effect in simple partially miscible binary biphasic mixtures
Maier HA, Hampe MJ, Bopp PA
Chemical Physics Letters, 518, 55, 2011
5 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
6 Structure and Dynamics of Water Confined in Single-Wall Nanotubes
Nanok T, Artrith N, Pantu P, Bopp PA, Limtrakul J
Journal of Physical Chemistry A, 113(10), 2103, 2009
7 Scope and limits of molecular simulations
Bopp PA, Buhn JB, Maier HA, Hampe MJ
Chemical Engineering Communications, 195(11), 1437, 2008
8 A molecular dynamics study of a liquid-liquid interface: structure and dynamics
Buhn JB, Bopp PA, Hampe MJ
Fluid Phase Equilibria, 224(2), 221, 2004
9 Coupled molecular dynamics/semiempirical simulation of organic solutes in polar liquids. I. Naphthalene in acetonitrile
Cichos F, Brown R, Bopp PA
Journal of Chemical Physics, 114(15), 6824, 2001
10 Coupled molecular dynamics/semiempirical simulation of organic solutes in polar liquids. II. Coumarin 153 in methanol and acetonitrile
Cichos F, Brown R, Bopp PA
Journal of Chemical Physics, 114(15), 6834, 2001