Jan Jirsák
Jan Jirsák
Associate Professor, J. E. Purkyně University in Ústí nad Labem
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Molecular simulation of aqueous electrolyte solubility. 2. Osmotic ensemble Monte Carlo methodology for free energy and solubility calculations and application to NaCl
F Moucka, M Lísal, J Škvor, J Jirsák, I Nezbeda, WR Smith
The Journal of Physical Chemistry B 115 (24), 7849-7861, 2011
Hard-sphere radial distribution function again
A Trokhymchuk, I Nezbeda, J Jirsák, D Henderson
Journal of Chemical Physics 123 (2), 24501-24501, 2005
Separation of racemic compound by nanofibrous composite membranes with chiral selector
J Gaálová, F Yalcinkaya, P Cuřínová, M Kohout, B Yalcinkaya, M Koštejn, ...
Journal of Membrane Science 596, 117728, 2020
Insight into electrospinning via molecular simulations
J Jirsák, F Moučka, I Nezbeda
Industrial & Engineering Chemistry Research 53 (19), 8257-8264, 2014
Toward a statistical mechanical theory for water: Analytical theory for a short-ranged reference system
J Jirsák, I Nezbeda
The Journal of chemical physics 127 (12), 124508, 2007
Water and aqueous solutions: simple non-speculative model approach
I Nezbeda, J Jirsák
Physical Chemistry Chemical Physics 13 (44), 19689-19703, 2011
Erratum:“Hard sphere radial distribution function again”[J. Chem. Phys. 123, 024501 (2005)]
A Trokhymchuk, I Nezbeda, J Jirsák, D Henderson
The Journal of Chemical Physics 124 (14), 149902, 2006
Preparation of PSEBS membranes bearing (S)-(−)-methylbenzylamine as chiral selector
M Otmar, J Gaálová, J Žitka, L Brožová, P Cuřínová, M Kohout, Š Hovorka, ...
European Polymer Journal 122, 109381, 2020
Aqueous electrolyte surfaces in strong electric fields: molecular insight into nanoscale jets and bridges
J Jirsák, F Moučka, J Škvor, I Nezbeda
Molecular Physics 113 (8), 848-853, 2015
Molecular-based equation of state for TIP4P water
J Jirsák, I Nezbeda
Journal of Molecular Liquids 136 (3), 310-316, 2007
Molecular mechanisms underlying the thermodynamic properties of water
J Jirsak, I Nezbeda
Journal of Molecular Liquids 134 (1-3), 99-106, 2007
A general method for determining molecular interfaces and layers
J Škvor, J Škvára, J Jirsák, I Nezbeda
Journal of Molecular Graphics and Modelling 76, 17-35, 2017
Molecular simulation of caloric properties of fluids modelled by force fields with intramolecular contributions: Application to heat capacities
WR Smith, J Jirsák, I Nezbeda, W Qi
The Journal of chemical physics 147 (3), 034508, 2017
Application of molecular simulations: Insight into the liquid bridging and jetting phenomena
I Nezbeda, J Jirsák, F Moučka, WR Smith
Condensed Matter Physics 18 (1), 13602, 2014
Molecular dynamics simulation study of the effect of a strong electric field on the structure of a poly (oxyethylene) chain in explicit solvents
Š Dědičová, J Dočkal, F Moučka, J Jirsák
Journal of Molecular Liquids 338, 116622, 2021
Molecular modeling and simulations
I Nezbeda, J Jirsák, F Moučka
Electrospun Nanofibers, 255-275, 2017
Enthalpies of vaporization of n-alkanes from the enlarged fused hard sphere model
J Jirsák, T Boublík
Fluid phase equilibria 226, 295-300, 2004
Solubility in the CuCl 2-NaCl-H 2 O System and Hydration Analysis in the Case of Complexation
J Eysseltová, V Zbranek, J Jirsák
Collection of Czechoslovak Chemical Communications 64 (8), 1262-1268, 1999
A Molecular-Level Picture of Electrospinning
J Jirsák, P Pokorný, P Holec, Š Dědičová
Water 12 (9), 2577, 2020
Toward a simple molecular theory of hydrophobic hydration
J Jirsák, J Škvor, I Nezbeda
Journal of Molecular Liquids 189, 13-19, 2014
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