Search Results - "Hansen, F Y"

Diffusion of water and selected atoms in DMPC lipid bilayer membranes by Hansen, F Y, Peters, G H, Taub, H, Miskowiec, A

“…Molecular dynamics simulations have been used to determine the diffusion of water molecules as a function of their position in a fully hydrated freestanding…”
Get more information

On the freezing behavior and diffusion of water in proximity to single-supported zwitterionic and anionic bilayer lipid membranes by Miskowiec, A., Buck, Z. N., Brown, M. C., Kaiser, H., Hansen, F. Y., King, G. M., Taub, H., Jiji, R., Cooley, J. W., Tyagi, M., Diallo, S. O., Mamontov, E., Herwig, K. W.

“…We compare the freezing/melting behavior of water hydrating single-supported bilayers of a zwitterionic lipid DMPC with that of an anionic lipid DMPG. For both…”
Get full text

Localized diffusive motion on two different time scales in solid alkane nanoparticles by Wang, S.-K, Mamontov, E, Bai, M, Hansen, F. Y, Taub, H, Copley, J. R. D, García Sakai, V, Gasparovic, G, Jenkins, T, Tyagi, M, Herwig, K. W, Neumann, D. A, Montfrooij, W, Volkmann, U. G

“…High-energy-resolution quasielastic neutron scattering on three complementary spectrometers has been used to investigate molecular diffusive motion in solid…”
Get full text

Nanoscale observation of delayering in alkane films by Bai, M, Knorr, K, Simpson, M. J, Trogisch, S, Taub, H, Ehrlich, S. N, Mo, H, Volkmann, U. G, Hansen, F. Y

“…Tapping-mode Atomic Force Microscopy and synchrotron X-ray scattering measurements on dotriacontane (n-C32H66 or C32) films adsorbed on SiO2-coated Si(100)…”
Get full text

Structure and dynamics of water and lipid molecules in charged anionic DMPG lipid bilayer membranes by Rønnest, A K, Peters, G H, Hansen, F Y, Taub, H, Miskowiec, A

“…Molecular dynamics simulations have been used to investigate the influence of the valency of counter-ions on the structure of freestanding bilayer membranes of…”
Get more information

The Effect of the Atomic Dynamics in a Crystalline Catalyst on the Rate Constant for a Catalyzed Chemical Reaction by Hansen, F. Y

“…Transition-state theory is often used to calculate the rate constant of a chemical reaction. Usually, it gives quite good results for gas-phase reactions but…”
Get full text

Effect of melittin on water diffusion and membrane structure in DMPC lipid bilayers by Buck, Z. N., Torres, J., Miskowiec, A., Mamontov, E., Kaiser, H., Hansen, F. Y., Taub, H., Tyagi, M., Collins, L., Herwig, K. W.

“…Quasielastic neutron scattering (QENS) is well suited for studying the dynamics of water in proximity to supported membranes whose structure can be…”
Get full text

A novel growth mode of alkane films on a SiO2 surface by MO, H, TAUB, H, VOLKMANN, U. G, PINO, M, EHRLICH, S. N, HANSEN, F. Y, LU, E, MICELI, P

Get full text

Intramolecular diffusive motion in alkane monolayers studied by high-resolution quasielastic neutron scattering and molecular dynamics simulations by Hansen, F Y, Criswell, L, Fuhrmann, D, Herwig, K W, Diama, A, Dimeo, R M, Neumann, D A, Volkmann, U G, Taub, H

“…Molecular dynamics simulations of a tetracosane (n-C24H50) monolayer adsorbed on a graphite basal-plane surface show that there are diffusive motions…”
Get full text

Structure and growth of dotriacontane films on SiO2 and Ag(111) surfaces: synchrotron X-ray scattering and molecular dynamics simulations by Mo, H., Trogisch, S., Taub, H., Ehrlich, S. N., Volkmann, U. G., Hansen, F. Y., Pino, M.

“…We report synchrotron X‐ray scattering experiments and molecular dynamics simulations of the structure and growth mode of dotriacontane (n‐C32H66 or C32) films…”
Get full text

Growth of n-alkane films on a single-crystal substrate by Wu, Z., Ehrlich, S.N., Matthies, B., Herwig, K.W., Dai, Pengcheng, Volkmann, U.G., Hansen, F.Y., Taub, H.

“…The structure and growth mode of alkane films ( n-C nH 2n+2; n=4, 6, 7) adsorbed on a Ag(1 1 1) surface have been investigated by synchrotron X-ray scattering…”
Get full text

Study of water diffusion on single-supported bilayer lipid membranes by quasielastic neutron scattering by Bai, M., Miskowiec, A., Hansen, F. Y., Taub, H., Jenkins, T., Tyagi, M., Diallo, S. O., Mamontov, E., Herwig, K. W., Wang, S.-K.

“…High-energy-resolution quasielastic neutron scattering has been used to elucidate the diffusion of water molecules in proximity to single bilayer lipid…”
Get full text

Thermodynamic models from fluctuation solution theory analysis of molecular simulations by Christensen, S., Peters, G.H., Hansen, F.Y., Abildskov, J.

“…Fluctuation solution theory (FST) is employed to analyze results of molecular dynamics (MD) simulations of liquid mixtures. The objective is to generate…”
Get full text

Generation of thermodynamic data for organic liquid mixtures from molecular simulations by Christensen, S., Peters, G. H., Hansen, F. Y., O'connell, J. P., Abildskov, J.

“…Fluctuation solution theory (FST) is employed to analyze results of molecular dynamics (MD) simulations of liquid mixtures. The objective is to generate…”
Get full text

Intramolecular and Lattice Melting in n -Alkane Monolayers: An Analog of Melting in Lipid Bilayers by Hansen, F. Y., Herwig, K. W., Matthies, B., Taub, H.

Get full text

Corrugation in the nitrogen-graphite potential probed by inelastic neutron scattering by HANSEN, F. Y, FRANK, V. L. P, TAUB, H, BRUCH, L. W, LAUTER, H. J, DENNISON, J. R

Get full text

Small-angle neutron scattering from a bisphenol A carbonate/dimethylsiloxane copolymer under uniaxial external stretch by Hammouda, B, Yelon, W. B, Lind, A. C, Hansen, F. Y

“…There is previous evidence that random copolymers of bisphenol A carbonate (BPAC) and dimethylsiloxane (DMS) form microdomain morphology. Small-angle neutron…”
Get full text

Molecular-dynamics study of the dynamical excitations in commensurate monolayer films of nitrogen molecules on graphite: A test of the corrugation in the nitrogen-graphite potential by Hansen, FY, Bruch, LW

Get full text

Collective excitations in ethane monolayers adsorbed on graphite (0001) surfaces by HANSEN, F. Y, WANG, R, TAUB, H, SHECHTER, H, REICHEL, D. G, DANNER, H. R, ALLDREDGE, G. P

Get full text

Decomposition of Molecular Motions into Translational, Rotational, and Intramolecular Parts by a Projection Operator Technique by Hansen, F. Y., Taub, H.

Get full text