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Kun Sun, Shiwei Zhang, Yajie Li, Zhijun Zhang, Haitao Li & Ruyi Mu. (2018) Monte Carlo simulation of gas free molecular flow in turbo molecular pump’s inlet tube. Molecular Simulation 44:15, pages 1261-1269.
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A.P. Lyubartsev, A. Laaksonen & P.N. Vorontsov-velyaminov. (1996) Determination of Free Energy from Chemical Potentials: Application of the Expanded Ensemble Method. Molecular Simulation 18:1-2, pages 43-58.
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AlexanderP. Lyubartsev, Aatto Laaksonen & PavelN. Vorontsov-Velyaminov. (1994) Free energy calculations for Lennard-Jones systems and water using the expanded ensemble method A Monte Carlo and molecular dynamics simulation study. Molecular Physics 82:3, pages 455-471.
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A.A. Martsinovski, S.V. Shevkunov & P.N. Vorontsov-Velyaminov. (1991) Study of Clustering in Nonideal Ion Plasma by a Combined Open Ensemble Monte Carlo - Cluster Expansion Method. Molecular Simulation 6:1-3, pages 143-151.
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Articles from other publishers (50)
S. V. Shevkunov. (2019) Computer Simulation of Water Vapor Adsorption on the Surface of a Crystal β-AgI Regular Shape Nanoparticle. Protection of Metals and Physical Chemistry of Surfaces 55:1, pages 41-49.
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S.V. Shevkunov & Jayant K. Singh. (2018) Bicanonical ensemble Monte Carlo simulation of water condensation in the field of crystal lattice defects. Journal of Molecular Liquids 264, pages 150-164.
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S.V. Shevkunov. (2016) Structure of water adsorbed in slit-shaped pores of silver iodide crystal. Computational and Theoretical Chemistry 1084, pages 1-16.
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S. V. Shevkunov. (2015) Structure and stability of hydrogen bonds under conditions of heating in nanopores. High Temperature 53:2, pages 259-271.
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S. V. Shevkunov. (2014) The hydrate shell of a Cl− ion in a planar nanopore. Thermodynamic stability. Russian Journal of Electrochemistry 50:12, pages 1127-1136.
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S. V. Shevkunov. (2014) The hydrate shell of a Cl− Ion in a planar nanopore, structure. Russian Journal of Electrochemistry 50:12, pages 1118-1126.
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S. V. Shevkunov. (2014) Thermodynamic characteristics of the hydrate shell of a Na+ ion in a plane nanopore with hydrophobic walls. Russian Journal of Physical Chemistry A 88:12, pages 2165-2171.
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S. V. Shevkunov. (2014) Molecular structure of finely disperse Na+Cl−(H2O) n aerosol particles in water vapor. Colloid Journal 76:6, pages 753-764.
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S. V. Shevkunov. (2014) Water in extremely narrow planar pores with crystalline walls. 2. Thermodynamics. Colloid Journal 76:2, pages 240-254.
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S. V. Shevkunov. (2014) Water in extremely narrow planar pores with crystalline walls. 1. Structure. Colloid Journal 76:2, pages 221-239.
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S. V. Shevkunov. (2014) Structure of water in microscopic fractures of a silver iodide crystal. Russian Journal of Physical Chemistry A 88:2, pages 313-319.
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S. P. Fisenko. (2013) Microstructure of the supersaturation field in homogeneous nucleation in a vapor-gas mixture. Technical Physics 58:5, pages 658-663.
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Zouhaier S. Zidi. (2012) On the stability of ion water clusters at atmospheric conditions: Open system Monte Carlo simulation. The Journal of Chemical Physics 137:12, pages 124107.
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S. V. Shevkunov. (2012) Collective interactions in the mechanism of adhesion of condensed phase nuclei to a crystal surface. 2. Thermodynamic stability. Colloid Journal 74:5, pages 608-626.
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S. V. Shevkunov. (2012) Collective interactions in the mechanism of adhesion of condensed phase nuclei to a crystal surface. 1. Spatial organization. Colloid Journal 74:5, pages 589-607.
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S. V. Shevkunov. (2012) Nucleation of water vapors at temperatures above the boiling point in the presence of ion admixtures. High Temperature 50:2, pages 255-264.
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S. V. Shevkunov. (2011) Effect of chlorine ions on the stability of nucleation cores in condensing water vapors. Russian Journal of Physical Chemistry A 85:9, pages 1584-1591.
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S. V. Shevkunov. (2011) Crisis of stability of hydration shell of Na+ ion in condensing water vapor. Colloid Journal 73:2, pages 275-286.
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S. V. Shevkunov. (2011) Nucleation of water vapor on Na+Cl− ion pairs: Computer simulation. Colloid Journal 73:1, pages 135-145.
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S. V. Shevkunov. (2010) Charge separation in Na+Cl-(H2O) n clusters in water vapors. 1. Intermolecular interactions. Colloid Journal 72:1, pages 93-106.
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S. V. Shevkunov. (2009) Polarization effects in Cl−(H2O) n clusters. Computer simulation. Colloid Journal 71:3, pages 406-421.
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S. V. Shevkunov. (2009) Numerical simulation of water vapor nucleation on electrically neutral nanoparticles. Journal of Experimental and Theoretical Physics 108:3, pages 447-468.
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S. V. Shevkunov. (2009) Nonpair interactions in Na+(H2O) n clusters under thermal fluctuation conditions. Russian Journal of Physical Chemistry A 83:6, pages 972-978.
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S. V. Shevkunov. (2009) Stimulation of vapor nucleation on perfect and imperfect hexagonal lattice surfaces. Journal of Experimental and Theoretical Physics 107:6, pages 965-983.
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S. V. Shevkunov. (2008) Structural transition in the OH−(H2O) n cluster in water vapors. Colloid Journal 70:6, pages 784-795.
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S. V. Shevkunov. (2008) The structure of the hydration shell of the ionized HCl molecule in water vapor. Russian Journal of Physical Chemistry A 82:11, pages 1878-1884.
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S. V. Shevkunov. (2008) Charge separation in water molecule clusters under thermal fluctuations: 1. Intermolecular interactions. Colloid Journal 70:5, pages 630-645.
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S. V. Shevkunov. (2007) Supramolecular mechanisms responsible for the high activity of aerosol stimulants of atmospheric moisture nucleation. Russian Journal of Physical Chemistry A 81:12, pages 2047-2052.
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S. V. Shevkunov. (2007) Nucleation of water vapor in microcracks on the surface of β-AgI aerosol particles: 2. Thermodynamics of nucleation. Colloid Journal 69:3, pages 378-390.
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S. V. Shevkunov. (2007) Nucleation of water vapor in microcracks on the surface of β-AgI aerosol particles: 1. The structure of nuclei. Colloid Journal 69:3, pages 360-377.
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S.I. Lukyanov, Z.S. Zidi & S.V. Shevkunov. (2007) Ion–water cluster free energy computer simulation using some of most popular ion–water and water–water pair interaction models. Chemical Physics 332:2-3, pages 188-202.
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S. V. Shevkunov. (2006) Clusterization of water molecules on crystalline β-AgI surface. Computer experiment. Colloid Journal 68:5, pages 632-643.
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S. V. Shevkunov. (2006) Water vapor nucleation on an infinite substrate with complementary structure: 1. The mechanism of nucleation. Colloid Journal 68:3, pages 357-369.
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S. V. Shevkunov. (2006) Layer-by-layer adsorption of water molecules on the surface of a silver iodide crystal. Russian Journal of Physical Chemistry 80:5, pages 769-775.
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S. V. Shevkunov. (2005) Adsorption of Water Vapor on the AgI Surface: A Computer Experiment. Russian Journal of General Chemistry 75:10, pages 1632-1642.
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S.I. Lukyanov, Z.S. Zidi & S.V. Shevkunov. (2005) Bicanonical Monte Carlo simulation of the structural properties of Cl−(H2O)N clusters using entropy data based model. Journal of Molecular Structure: THEOCHEM 725:1-3, pages 191-206.
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S.I. Lukyanov, Z.S. Zidi & S.V. Shevkunov. (2005) Monte Carlo bicanonical ensemble simulation for sodium cation hydration free energy in liquid water. Fluid Phase Equilibria 233:1, pages 34-46.
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S. V. Shevkunov. (2005) Formation of the transition layer at the vapor-crystal interface. Doklady Physics 50:5, pages 234-238.
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Sergey V. Shevkunov, Sergey I. Lukyanov, Jean-Marc Leyssale & Claude Millot. (2005) Computer simulation of Cl− hydration in anion–water clusters. Chemical Physics 310:1-3, pages 97-107.
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S. V. Shevkunov. (2004) Computer simulation of molecular complexes H3O+(H2O)n under conditions of thermal fluctuations: II. Work of formation and structure. Russian Journal of General Chemistry 74:10, pages 1471-1477.
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S. V. Shevkunov. (2004) Computer simulation of molecular complexes H3O+(H2O)n under conditions of thermal fluctuations: I. Interactions in the system. Russian Journal of General Chemistry 74:9, pages 1305-1312.
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S.I. Lukyanov, Z.S. Zidi & S.V. Shevkunov. (2003) Study of Aqvist's ion–water interaction model in Na+–water clusters: free energy and structure. Journal of Molecular Structure: THEOCHEM 623:1-3, pages 221-236.
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M. Athènes. (2002) Computation of a chemical potential using a residence weight algorithm. Physical Review E 66:4.
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S. V. Shevkunov. (2001) Scattering of centimeter radiowaves in a gas ionized by radioactive radiation: Cluster plasma formation. Journal of Experimental and Theoretical Physics 92:3, pages 420-440.
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Alice Vegiri & Sergei V. Shevkunov. (2000) Hydration shell structure of the OH−(H2O)n=1–15 clusters from a model potential energy function. The Journal of Chemical Physics 113:19, pages 8521-8530.
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S. V. Shevkunov. (2000) Exchange symmetry in a system of nonrelativistic spin-1/2 fermions in the Feynman quantum statistics representation. Journal of Experimental and Theoretical Physics 91:1, pages 31-47.
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Sergey V. Shevkunov & Alice Vegiri. (1999) Examination of the structural properties of the H3O+(H2O)n clusters in the (μPT) Grand Canonical ensemble, by employing a new many-body potential-energy function. The Journal of Chemical Physics 111:20, pages 9303-9314.
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P.N. Vorontsov-Velyaminov, D.A. Ivanov, S.D. Ivanov & A.V. Broukhno. (1999) Expanded ensemble Monte Carlo calculations of free energy for closed, stretched and confined lattice polymers. Colloids and Surfaces A: Physicochemical and Engineering Aspects 148:1-2, pages 171-177.
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A. P. Lyubartsev, O. K. Fo/rrisdahl & A. Laaksonen. (1998) Solvation free energies of methane and alkali halide ion pairs: An expanded ensemble molecular dynamics simulation study. The Journal of Chemical Physics 108:1, pages 227-233.
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A. P. Lyubartsev, A. A. Martsinovski, S. V. Shevkunov & P. N. Vorontsov-Velyaminov. (1992) New approach to Monte Carlo calculation of the free energy: Method of expanded ensembles. The Journal of Chemical Physics 96:3, pages 1776-1783.
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