| 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 | 108 | 2011 |
| Hard-sphere radial distribution function again A Trokhymchuk, I Nezbeda, J Jirsák, D Henderson Journal of Chemical Physics 123 (2), 24501-24501, 2005 | 102 | 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 | 39 | 2020 |
| Insight into electrospinning via molecular simulations J Jirsák, F Moučka, I Nezbeda Industrial & Engineering Chemistry Research 53 (19), 8257-8264, 2014 | 32 | 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 | 23 | 2007 |
| Water and aqueous solutions: simple non-speculative model approach I Nezbeda, J Jirsák Physical Chemistry Chemical Physics 13 (44), 19689-19703, 2011 | 19 | 2011 |
| 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 | 18 | 2020 |
| 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 | 16 | 2006 |
| 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 | 13 | 2015 |
| Molecular-based equation of state for TIP4P water J Jirsák, I Nezbeda Journal of Molecular Liquids 136 (3), 310-316, 2007 | 13 | 2007 |
| Molecular mechanisms underlying the thermodynamic properties of water J Jirsak, I Nezbeda Journal of Molecular Liquids 134 (1-3), 99-106, 2007 | 11 | 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 | 10 | 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 | 8 | 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 | 8 | 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 | 7 | 2021 |
| 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 | 6 | 1999 |
| Molecular modeling and simulations I Nezbeda, J Jirsák, F Moučka Electrospun Nanofibers, 255-275, 2017 | 5 | 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 | 5 | 2004 |
| A Molecular-Level Picture of Electrospinning J Jirsák, P Pokorný, P Holec, Š Dědičová Water 12 (9), 2577, 2020 | 4 | 2020 |
| Toward a simple molecular theory of hydrophobic hydration J Jirsák, J Škvor, I Nezbeda Journal of Molecular Liquids 189, 13-19, 2014 | 4 | 2014 |
Ivo Nezbedaacademy of sciences, pragueDirección de correo verificada de icpf.cas.cz
