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au.\*:("FURUKAWA, Shin-Ichi")

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A study of permeation of n-butane through ZSM-5 membrane by using Monte carlo and equilibrium/non-equilibrium molecular dynamics simulationsFURUKAWA, Shin-Ichi; NITTA, Tomoshige.Journal of chemical engineering of Japan. 2003, Vol 36, Num 3, pp 313-321, issn 0021-9592, 9 p.Article

A new algorithm of Boundary-Driven type Non-Equilibrium molecular dynamics for simulating membrane permeation of gas mixturesFURUKAWA, Shin-Ichi; NITTA, Tomoshige.Journal of chemical engineering of Japan. 2005, Vol 38, Num 4, pp 278-282, issn 0021-9592, 5 p.Article

Monte Carlo simulation studies on adsorption of propane/propylene in NaX zeoliteZHANG, Yi; FURUKAWA, Shin-Ichi; NITTA, Tomoshige et al.Journal of chemical engineering of Japan. 2004, Vol 37, Num 4, pp 563-567, issn 0021-9592, 5 p.Article

Molecular simulation studies on adsorption of propane/propylene in NaA zeolite by using a Monte Carlo techniqueYI ZHANG; FURUKAWA, Shin-Ichi; NITTA, Tomoshige et al.Journal of chemical engineering of Japan. 2003, Vol 36, Num 9, pp 1085-1094, issn 0021-9592, 10 p.Article

Computer simulation studies on gas permeation of propane and propylene across ZSM-5 membranes by a non-equilibrium molecular dynamics techniqueYI ZHANG; FURUKAWA, Shin-Ichi; NITTA, Tomoshige et al.Separation and purification technology. 2003, Vol 32, Num 1-3, pp 215-221, issn 1383-5866, 7 p.Conference Paper

Molecular dynamics studies on clustering process of solute molecules through rapid expansion of supercritical fluidsFURUKAWA, Shin-Ichi; KATO, Satoshi; NITTA, Tomoshige et al.Fluid phase equilibria. 2004, Vol 219, Num 1, pp 33-36, issn 0378-3812, 4 p.Conference Paper

Molecular simulation study on adsorption and diffusion behavior of ethanol/water molecules in NaA zeolite crystalFURUKAWA, Shin-Ichi; GODA, Keigo; ZHANG, Yi et al.Journal of chemical engineering of Japan. 2004, Vol 37, Num 1, pp 67-74, issn 0021-9592, 8 p.Article

Non-equilibrium MD simulation studies on effects of structural difference in outer surfaces of a silicalite membrane on effusion processes of propaneFURUKAWA, Shin-Ichi; FUJISAWA, Akitoshi; MORISAWA, Satoshi et al.Journal of chemical engineering of Japan. 2005, Vol 38, Num 9, pp 677-683, issn 0021-9592, 7 p.Article

Quantum-phase dynamics of two-component Bose-Einstein condensates : Collapse-revival of macroscopic superposition statesNAKANO, Masayoshi; KISHI, Ryohei; OHTA, Suguru et al.Physica. B, Condensed matter. 2005, Vol 370, Num 1-4, pp 110-120, issn 0921-4526, 11 p.Article

A molecular simulation study on adsorption of acetone/water in mesoporous silicas modified by pore surface silylationFURUKAWA, Shin-Ichi; NISHIUMI, Toshihiro; AOYAMA, Naoki et al.Journal of chemical engineering of Japan. 2005, Vol 38, Num 12, pp 999-1007, issn 0021-9592, 9 p.Article

Theoretical study on the second hyperpolarizabilities of tetrathiafulvalene (TTF) and tetrathiapentalene (TTP) using highly correlated ab initio MO and the density functional theory methodsYAMADA, Satoru; NAKANO, Masayoshi; KISHI, Ryohei et al.Synthetic metals. 2006, Vol 156, Num 5-6, pp 375-378, issn 0379-6779, 4 p.Article

Molecular simulation study on adsorption of methanol/water mixtures in mesoporous silicas modified pore surface silylationAOYAMA, Naoki; YOSHIHARA, Tsukasa; FURUKAWA, Shin-Ichi et al.Fluid phase equilibria. 2007, Vol 257, Num 2, pp 212-216, issn 0378-3812, 5 p.Conference Paper

Hydration effects on the reaction with an open-shell transition state: QM/MM-ER study for the dehydration reaction of alcohol in hot waterTAKAHASHI, Hideaki; MIKI, Fumihiro; OHNO, Hajime et al.Journal of mathematical chemistry. 2009, Vol 46, Num 3, pp 781-794, issn 0259-9791, 14 p.Conference Paper

Non-equilibrium molecular dynamics simulation study on permeation phenomena of LJ particles in slit-shaped membranes with periodic belt-like heterogeneous surfacesYONEMORI, Ken-Ichiro; TAKITANI, Atsushi; FURUKAWA, Shin-Ichi et al.Fluid phase equilibria. 2007, Vol 257, Num 2, pp 190-194, issn 0378-3812, 5 p.Conference Paper

Polarization Mode Coupling and Spatial Power Spectrum of Fluctuations Along a Highly Birefringent Holey FiberSHIBATA, Nori; OHASHI, Masaharu; WAKABAYASHI, Tomohiro et al.Journal of lightwave technology. 2009, Vol 27, Num 9-12, pp 1269-1278, issn 0733-8724, 10 p.Article

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