-
1
-
-
0000026966
-
Explicit reversible integrators for extended systems dynamics
-
GJ Martyna ME Tuckerman DJ Tobias ML Klein Explicit reversible integrators for extended systems dynamics Mol Phys 87 1996 1117 1157
-
(1996)
Mol Phys
, vol.87
, pp. 1117-1157
-
-
Martyna, GJ1
Tuckerman, ME2
Tobias, DJ3
Klein, ML4
-
2
-
-
0001060901
-
Surface tension of water droplets: a molecular dynamics study of model and size dependencies
-
W Zakharov EN Brodskaya A Laaksonen Surface tension of water droplets: a molecular dynamics study of model and size dependencies J Chem Phys 107 1997 10675 10683
-
(1997)
J Chem Phys
, vol.107
, pp. 10675-10683
-
-
Zakharov, W1
Brodskaya, EN2
Laaksonen, A3
-
3
-
-
36449008627
-
Molecular dynamics simulation of the orthobaric densities and surface-tension of water
-
J Alejandre DJ Tildesley A Chapela Molecular dynamics simulation of the orthobaric densities and surface-tension of water J Chem Phys 102 1995 4574 4583
-
(1995)
J Chem Phys
, vol.102
, pp. 4574-4583
-
-
Alejandre, J1
Tildesley, DJ2
Chapela, A3
-
4
-
-
0031275870
-
Molecular dynamics study of two-component systems: the shape and surface structure of water/ethanol droplets
-
M Tarek ML Klein Molecular dynamics study of two-component systems: the shape and surface structure of water/ethanol droplets J Phys Chem A 101 1997 8639 8642 of outstanding interest
-
(1997)
J Phys Chem A
, vol.101
, pp. 8639-8642
-
-
Tarek, M1
Klein, ML2
-
5
-
-
36449000574
-
Binary homogeneous nucleation theory for the gas-liquid transition — a nonclassical approach
-
XC Zeng DW Oxtoby Binary homogeneous nucleation theory for the gas-liquid transition — a nonclassical approach J Chem Phys 95 1991 5940 5947
-
(1991)
J Chem Phys
, vol.95
, pp. 5940-5947
-
-
Zeng, XC1
Oxtoby, DW2
-
6
-
-
0000185878
-
Measurement of the molecular content of binary nuclei — use of the nucleation rate surface for ethanol-hexanol
-
R Strey Y Viisanen Measurement of the molecular content of binary nuclei — use of the nucleation rate surface for ethanol-hexanol J Chem Phys 99 1993 4693 4704
-
(1993)
J Chem Phys
, vol.99
, pp. 4693-4704
-
-
Strey, R1
Viisanen, Y2
-
7
-
-
0031211552
-
Three-dimensional structure in water-methanol mixtures
-
A Laaksonen PG Kusalik IM Svishchev Three-dimensional structure in water-methanol mixtures J Phys Chem 101 1997 5910 5918
-
(1997)
J Phys Chem
, vol.101
, pp. 5910-5918
-
-
Laaksonen, A1
Kusalik, PG2
Svishchev, IM3
-
8
-
-
0001627743
-
Small angle neutron scattering from nanodroplet aerosols
-
BE Wyslouzil JL Cheung G Wilemski R Strey Small angle neutron scattering from nanodroplet aerosols Phys Rev Lett 79 1997 431 434 of special interest
-
(1997)
Phys Rev Lett
, vol.79
, pp. 431-434
-
-
Wyslouzil, BE1
Cheung, JL2
Wilemski, G3
Strey, R4
-
9
-
-
33748498683
-
Optical second harmonic generation studies of azobenzene surfactant adsorption and photochemistry at the water/1,2-dichloroethane interface
-
RR Naujok HJ Paul RM Corn Optical second harmonic generation studies of azobenzene surfactant adsorption and photochemistry at the water/1,2-dichloroethane interface J Phys Chem 100 1996 10497 10507
-
(1996)
J Phys Chem
, vol.100
, pp. 10497-10507
-
-
Naujok, RR1
Paul, HJ2
Corn, RM3
-
10
-
-
0030740282
-
Ordering of interfacial water molecules at the charged air/water interface observed by vibrational sum frequency generation
-
DE Gragson BM McCarty GL Richmond Ordering of interfacial water molecules at the charged air/water interface observed by vibrational sum frequency generation J Am Chem Soc 119 1997 6144 6152
-
(1997)
J Am Chem Soc
, vol.119
, pp. 6144-6152
-
-
Gragson, DE1
McCarty, BM2
Richmond, GL3
-
11
-
-
0000482313
-
Theory and computer-simulations of solvation and chemical-reactions at liquid interfaces
-
I Benjamin Theory and computer-simulations of solvation and chemical-reactions at liquid interfaces Accounts Chem Res 28 1995 233 239
-
(1995)
Accounts Chem Res
, vol.28
, pp. 233-239
-
-
Benjamin, I1
-
12
-
-
0008085515
-
Structure and electrostatics of the surfactant-water interface
-
JC Shelley M Sprik ML Klein Structure and electrostatics of the surfactant-water interface Progr Colloid Polym Sci 103 1997 146 154 of special interest
-
(1997)
Progr Colloid Polym Sci
, vol.103
, pp. 146-154
-
-
Shelley, JC1
Sprik, M2
Klein, ML3
-
13
-
-
0000253253
-
Structure of liquid-cryatalline phases formed by sodium dodecylsulfate and water as determined by optical microscopy, X-ray diffraction and nucler magnetic resonance spectroscopy
-
ID Leigh MP McDonald RM Wood GJT Tiddy MA Trevethan Structure of liquid-cryatalline phases formed by sodium dodecylsulfate and water as determined by optical microscopy, X-ray diffraction and nucler magnetic resonance spectroscopy J Chem Soc Faraday Trans 77 1981 2867 2876
-
(1981)
J Chem Soc Faraday Trans
, vol.77
, pp. 2867-2876
-
-
Leigh, ID1
McDonald, MP2
Wood, RM3
Tiddy, GJT4
Trevethan, MA5
-
14
-
-
0030218457
-
The ‘new’ science of ‘complex fluids’
-
WM Gelbart A Ben-Shaul The ‘new’ science of ‘complex fluids’ J Phys Chem 100 1996 13169 13189
-
(1996)
J Phys Chem
, vol.100
, pp. 13169-13189
-
-
Gelbart, WM1
Ben-Shaul, A2
-
15
-
-
0001708745
-
Surfactant/water interactions at the air/water interface probed by vibrational sum frequency generation
-
DE Gragson BM McCarty GL Richmond Surfactant/water interactions at the air/water interface probed by vibrational sum frequency generation J Phys Chem 100 1996 14272 14275
-
(1996)
J Phys Chem
, vol.100
, pp. 14272-14275
-
-
Gragson, DE1
McCarty, BM2
Richmond, GL3
-
17
-
-
4043049343
-
Structure of hydrocarbon chains in surfactant monolayers at the air/water interface: neutron reflection from dodecyl trimcthylammonium bromide
-
JR Lu M Hromadova RK Thomas J Penfold Structure of hydrocarbon chains in surfactant monolayers at the air/water interface: neutron reflection from dodecyl trimcthylammonium bromide J Chem Soc Faraday Trans 92 1996 403 408
-
(1996)
J Chem Soc Faraday Trans
, vol.92
, pp. 403-408
-
-
Lu, JR1
Hromadova, M2
Thomas, RK3
Penfold, J4
-
18
-
-
0001480302
-
Simulation of sodium dodecylsulfate at the water-vapor and water-carbon-tetrachloride interfaces at low surface coverage
-
KJ Schweighofer U Essmann M Berkowitz Simulation of sodium dodecylsulfate at the water-vapor and water-carbon-tetrachloride interfaces at low surface coverage J Phys Chem B 101 1997 3793 3799 of special interest
-
(1997)
J Phys Chem B
, vol.101
, pp. 3793-3799
-
-
Schweighofer, KJ1
Essmann, U2
Berkowitz, M3
-
19
-
-
0000098551
-
Molecular dynamics simulation of the interfacial behavior of a heptane/water system in the presence of nonylphenol tryethoxylated surfactants. 1. Surface energy, surface entropy, and interaction energies as a function of temperature and surfactant concentration
-
G Urbina-Villalba RM Landrove JA Guaregua Molecular dynamics simulation of the interfacial behavior of a heptane/water system in the presence of nonylphenol tryethoxylated surfactants. 1. Surface energy, surface entropy, and interaction energies as a function of temperature and surfactant concentration Langmuir 13 1997 1644 1652
-
(1997)
Langmuir
, vol.13
, pp. 1644-1652
-
-
Urbina-Villalba, G1
Landrove, RM2
Guaregua, JA3
-
20
-
-
0029887618
-
Simple theoretical framework for a systematic molecular dynamics study of the interfacial properties of oil/water systems in the presence of surfactant molecules
-
G Urbina-Villalba I Reif Simple theoretical framework for a systematic molecular dynamics study of the interfacial properties of oil/water systems in the presence of surfactant molecules Colloid Surf A 106 1996 175 190
-
(1996)
Colloid Surf A
, vol.106
, pp. 175-190
-
-
Urbina-Villalba, G1
Reif, I2
-
21
-
-
0028736821
-
Direct visualization of surfactant hemimicelles by force microscopy of the electrical double layer
-
S Manne JP Cleveland HE Gaub GD Stucky PK Hansma Direct visualization of surfactant hemimicelles by force microscopy of the electrical double layer Langmuir 10 1994 4409 4413
-
(1994)
Langmuir
, vol.10
, pp. 4409-4413
-
-
Manne, S1
Cleveland, JP2
Gaub, HE3
Stucky, GD4
Hansma, PK5
-
22
-
-
0029488435
-
Molecular organization of surfactants at solid-liquid interfaces
-
S Manne HE Gaub Molecular organization of surfactants at solid-liquid interfaces Science 270 1995 1480 1482
-
(1995)
Science
, vol.270
, pp. 1480-1482
-
-
Manne, S1
Gaub, HE2
-
23
-
-
0001366291
-
Surfactant aggregates at a metal surface
-
M Jaschke HJ Butt HE Gaub S Manne Surfactant aggregates at a metal surface Langmuir 13 1997 1381 1384 of special interest
-
(1997)
Langmuir
, vol.13
, pp. 1381-1384
-
-
Jaschke, M1
Butt, HJ2
Gaub, HE3
Manne, S4
-
24
-
-
0031556135
-
Self-assembly structures of nonionic surfactants at graphite/solution interfaces
-
HN Patrick GG Warr S Manne IA Aksay Self-assembly structures of nonionic surfactants at graphite/solution interfaces Langmuir 13 1997 4349 4356 of outstanding interest
-
(1997)
Langmuir
, vol.13
, pp. 4349-4356
-
-
Patrick, HN1
Warr, GG2
Manne, S3
Aksay, IA4
-
25
-
-
2942617311
-
Monte Carlo simulations of the adsorption of amphiphilic oligomers at hydrophobic interfaces
-
CM Wijmans P Linse Monte Carlo simulations of the adsorption of amphiphilic oligomers at hydrophobic interfaces J Chem Phys 106 1997 328 338
-
(1997)
J Chem Phys
, vol.106
, pp. 328-338
-
-
Wijmans, CM1
Linse, P2
-
26
-
-
0012002057
-
Grand canonical Monte Carlo simulations of a Stockmayer fluid in a slit micropore
-
KK Han JH Cushman DJ Diestler Grand canonical Monte Carlo simulations of a Stockmayer fluid in a slit micropore Mol Phys 79 1993 537 545
-
(1993)
Mol Phys
, vol.79
, pp. 537-545
-
-
Han, KK1
Cushman, JH2
Diestler, DJ3
-
27
-
-
36449009116
-
Confined thin films of a linear and branched octane – a comparison of the structure and solvation forces using molecular dynamics simulations
-
Y Wang K Hill JG Harris Confined thin films of a linear and branched octane – a comparison of the structure and solvation forces using molecular dynamics simulations J Chem Phys 100 1994 3276 3285
-
(1994)
J Chem Phys
, vol.100
, pp. 3276-3285
-
-
Wang, Y1
Hill, K2
Harris, JG3
-
28
-
-
0028404238
-
Flow behavior and shear induced transition near an isotropic-nematic transition in equilibrium polymers
-
V Schmitt F Lequeux A Pousse D Roux Flow behavior and shear induced transition near an isotropic-nematic transition in equilibrium polymers Langmuir 10 1994 955 961
-
(1994)
Langmuir
, vol.10
, pp. 955-961
-
-
Schmitt, V1
Lequeux, F2
Pousse, A3
Roux, D4
-
29
-
-
0028485116
-
Reduction of frictional forces between solid surfaces bearing polymer brushes
-
J Klein E Kumacheva D Mahalu D Perahia U Fetters Reduction of frictional forces between solid surfaces bearing polymer brushes Nature 370 1994 634 636
-
(1994)
Nature
, vol.370
, pp. 634-636
-
-
Klein, J1
Kumacheva, E2
Mahalu, D3
Perahia, D4
Fetters, U5
-
30
-
-
0002233896
-
The molecular dynamics simulation of boundary-layer lubrication
-
YC Kong DJ Tildesley J Alejandre The molecular dynamics simulation of boundary-layer lubrication Mol Phys 92 1997 7 18 of outstanding interest
-
(1997)
Mol Phys
, vol.92
, pp. 7-18
-
-
Kong, YC1
Tildesley, DJ2
Alejandre, J3
-
32
-
-
0028988796
-
2H nuclear magnetic resonance order parameter profiles suggest a change of molecular shape for phosphatidylcholines containing a polyunsaturated acyl chain
-
2H nuclear magnetic resonance order parameter profiles suggest a change of molecular shape for phosphatidylcholines containing a polyunsaturated acyl chain Biophys J 68 1995 2396 2403
-
(1995)
Biophys J
, vol.68
, pp. 2396-2403
-
-
Holte, LL1
Peter, SA2
Sinnwell, TM3
Gawrisch, K4
-
33
-
-
85119793086
-
-
K Merz B Roux Biological membranes: a molecular perspective from computation and experiment 1996 Birkhauser Boston
-
(1996)
-
-
-
34
-
-
0002883739
-
Atomic-scale molecular dynamics simulations of lipid membranes
-
DJ Tobias K Tu ML Klein Atomic-scale molecular dynamics simulations of lipid membranes Curr Opin Colloid Interface Sci 2 1997 115 126 of outstanding interest
-
(1997)
Curr Opin Colloid Interface Sci
, vol.2
, pp. 115-126
-
-
Tobias, DJ1
Tu, K2
Klein, ML3
-
35
-
-
0031268384
-
Computer simulation of a DPPC phospholipid bilayer: structural changes as a function of molecular surface area
-
SE Feller RM Venable RW Pastor Computer simulation of a DPPC phospholipid bilayer: structural changes as a function of molecular surface area Langmuir 13 1997 6555 6561
-
(1997)
Langmuir
, vol.13
, pp. 6555-6561
-
-
Feller, SE1
Venable, RM2
Pastor, RW3
-
36
-
-
0000065270
-
Hydrogen bonding of water to phosphatidylcholine in the membrane as studied by a molecular dynamics simulation: location, geometry, and lipid-lipid bridging via hydrogen-bonded water
-
PM Gierula Y Takaoka H Miyagawa K Kitamura A Kusumi Hydrogen bonding of water to phosphatidylcholine in the membrane as studied by a molecular dynamics simulation: location, geometry, and lipid-lipid bridging via hydrogen-bonded water J Phys Chem A 101 1997 3677 3691
-
(1997)
J Phys Chem A
, vol.101
, pp. 3677-3691
-
-
Gierula, PM1
Takaoka, Y2
Miyagawa, H3
Kitamura, K4
Kusumi, A5
-
37
-
-
0030844208
-
Molecular dynamics simulation of unsaturated lipid bilayers at low hydration: Parameterization and comparison with diffraction studies
-
SE Feller D Yin RW Pastor AD MacKerell Molecular dynamics simulation of unsaturated lipid bilayers at low hydration: Parameterization and comparison with diffraction studies Biophys J 73 1997 2269 2279 of outstanding interest
-
(1997)
Biophys J
, vol.73
, pp. 2269-2279
-
-
Feller, SE1
Yin, D2
Pastor, RW3
MacKerell, AD4
-
38
-
-
0038545002
-
Structure and dynamic properties of diunsaturated 1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphatidylcholine lipid bilayer from molecular dynamics simulation
-
MT Hyvonen TT Rantala MA Korpela Structure and dynamic properties of diunsaturated 1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphatidylcholine lipid bilayer from molecular dynamics simulation Biophys J 73 1997 2907 2923 of outstanding interest
-
(1997)
Biophys J
, vol.73
, pp. 2907-2923
-
-
Hyvonen, MT1
Rantala, TT2
Korpela, MA3
|