Fluid flow in nanopores: Accurate boundary conditions for carbon nanotubes V Sokhan, D Nicholson, N Quirke J Chem Phys 117 (18), 8531, 2002 | 339 | 2002 |
The free surface of water: molecular orientation, surface potential and nonlinear susceptibility V Sokhan, D Tildesley Molecular Physics 92 (4), 625-640, 1997 | 276 | 1997 |
Fluid flow in nanopores: An examination of hydrodynamic boundary conditions V Sokhan, D Nicholson, N Quirke J Chem Phys 115 (8), 3878, 2001 | 226 | 2001 |
Transport properties of nitrogen in single walled carbon nanotubes V Sokhan, D Nicholson, N Quirke J Chem Phys 120 (8), 3955, 2004 | 111 | 2004 |
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 | 88 | 2013 |
Phonon spectra in model carbon nanotubes V Sokhan, D Nicholson, N Quirke J Chem Phys 113 (5), 2007, 2000 | 81 | 2000 |
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 | 72 | 1984 |
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 | 65 | 2015 |
Slip coefficient in nanoscale pore flow VP Sokhan, N Quirke Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 78 (1 …, 2008 | 52 | 2008 |
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 | 50 | 2015 |
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 | 38 | 1996 |
Electronically coarse-grained model for water A Jones, F Cipcigan, VP Sokhan, J Crain, GJ Martyna Physical Review Letters 110 (22), 227801, 2013 | 35 | 2013 |
Structure and hydrogen bonding at the limits of liquid water stability F Cipcigan, V Sokhan, G Martyna, J Crain Scientific Reports 8, 1718, 2018 | 32 | 2018 |
Interfacial Friction and Collective Diffusion in Nanopores V Sokhan, N Quirke Molecular Simulation 30 (4), 217-224, 2004 | 29 | 2004 |
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 | 21 | 2019 |
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 | 21 | 2015 |
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 | 16 | 2013 |
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 | 14 | 2016 |
Viscous drag forces in gas operated pressure balances V Sokhan, J Quirke, Nicholas, Greenwood Molecular Simulation 31 (6-7), 535-542, 2005 | 10 | 2005 |
Dissipative particle dynamics: dissipative forces from atomistic simulation VP Sokhan, IY Todorov Molecular Simulations, 1 - 9, 2019 | 7 | 2019 |