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Vlad Sokhan
Vlad Sokhan
Computational Chemistry, STFC Daresbury Laboratory, Warrington, UK
在 stfc.ac.uk 的电子邮件经过验证 - 首页
标题
引用次数
引用次数
年份
Fluid flow in nanopores: Accurate boundary conditions for carbon nanotubes
V Sokhan, D Nicholson, N Quirke
J Chem Phys 117 (18), 8531, 2002
3372002
The free surface of water: molecular orientation, surface potential and nonlinear susceptibility
V Sokhan, D Tildesley
Molecular Physics 92 (4), 625-640, 1997
2751997
Fluid flow in nanopores: An examination of hydrodynamic boundary conditions
V Sokhan, D Nicholson, N Quirke
J Chem Phys 115 (8), 3878, 2001
2252001
Transport properties of nitrogen in single walled carbon nanotubes
V Sokhan, D Nicholson, N Quirke
J Chem Phys 120 (8), 3955, 2004
1102004
Quantum Drude oscillator model of atoms and molecules: Many-body polarization and dispersion interactions for atomistic simulation
AP Jones, J Crain, VP Sokhan, TW Whitfield, GJ Martyna
Physical Review B—Condensed Matter and Materials Physics 87 (14), 144103, 2013
822013
Phonon spectra in model carbon nanotubes
V Sokhan, D Nicholson, N Quirke
J Chem Phys 113 (5), 2007, 2000
812000
On the nature of disjoining pressure oscillations in fluid films
V Antonchenko, V Ilyin, N Makovsky, A Pavlov, V Sokhan
Molecular Physics 52 (2), 345-355, 1984
721984
Signature properties of water: Their molecular electronic origins
VP Sokhan, AP Jones, FS Cipcigan, J Crain, GJ Martyna
Proceedings of the National Academy of Sciences 112 (20), 6341-6346, 2015
622015
Slip coefficient in nanoscale pore flow
VP Sokhan, N Quirke
Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 78 (1 …, 2008
512008
Hydrogen bonding and molecular orientation at the liquid–vapour interface of water
FS Cipcigan, VP Sokhan, AP Jones, J Crain, GJ Martyna
Physical Chemistry Chemical Physics 17 (14), 8660-8669, 2015
482015
Molecular dynamics simulation of the non-linear optical susceptibility at the phenol/water/air interface
V Sokhan, D Tildesley
Faraday Discussions 104, 193-208, 1996
381996
Electronically coarse-grained model for water
A Jones, F Cipcigan, VP Sokhan, J Crain, GJ Martyna
Physical Review Letters 110 (22), 227801, 2013
332013
Structure and hydrogen bonding at the limits of liquid water stability
F Cipcigan, V Sokhan, G Martyna, J Crain
Scientific Reports 8, 1718, 2018
292018
Interfacial Friction and Collective Diffusion in Nanopores
V Sokhan, N Quirke
Molecular Simulation 30 (4), 217-224, 2004
282004
Molecular-scale remnants of the liquid-gas transition in supercritical polar fluids
VP Sokhan, A Jones, FS Cipcigan, J Crain, GJ Martyna
Physical review letters 115 (11), 117801, 2015
192015
Electronically coarse-grained molecular dynamics using quantum Drude oscillators
AP Jones, J Crain, FS Cipcigan, VP Sokhan, M Modani, GJ Martyna
Molecular Physics 111 (22-23), 3465-3477, 2013
162013
Electronic coarse graining: Predictive atomistic modeling of condensed matter
GJM F. S. Cipcigan, J. Crain, V. P. Sokhan
Reviews of Modern Physics 91 (2), 025003, 2019
152019
Electronic coarse graining enhances the predictive power of molecular simulation allowing challenges in water physics to be addressed
FS Cipcigan, VP Sokhan, J Crain, GJ Martyna
Journal of Computational Physics 326, 222-233, 2016
122016
Viscous drag forces in gas operated pressure balances
V Sokhan, J Quirke, Nicholas, Greenwood
Molecular Simulation 31 (6-7), 535-542, 2005
102005
Dissipative particle dynamics: dissipative forces from atomistic simulation
VP Sokhan, IY Todorov
Molecular Simulations, 1 - 9, 2019
52019
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