Bejelentkezés
Dr. Jedlovszky Pál
egyetemi docensÉlelmiszertudományi Intézet
Kémiai, Borászati kémiai és Borászati Tanszék
Folyóiratcikk
- M. Darvas, T. Gilányi, Jedlovszky Pál:
Competitive Adsorption of Surfactants and Polymers at the Free Water Surface. A Computer Simulation study of the Sodium Dodecylsulfate - Poly(ethylene oxide) System.
Journal of Physical Chemistry B 115, 933 - 944 (2011)
Impakt faktor: 3,603 - M. Darvas, M. Jorge, M. N. D. S. Cordeiro, Jedlovszky Pál:
Solvation free Energy Profile of the SCH Ion Across the Water - 1,2-Dichloroethane Liquid/Liquid Interface. A Computer Simulation Study..
Journal of Physical Chemistry C 115, 11140 - 11146 (2011)
Impakt faktor: 4,520 - A. Idrissi, I. Vyalov, M. Kiselev, Jedlovszky Pál:
Assessment of the potential models of acetone/CO2 and ethanol/CO2 mixture by computer simulation and thermodynamic integration in liquid and supercritical states.
Physical Chemistry Chemical Physics 13, 16272 - 16281 (2011)
Impakt faktor: 3,453 - A. Idrissi, M. Kiselev, I. Vyalov, M. Fedorov, Jedlovszky Pál:
Heterogeneity of the Local Structure in Sub and Supercritical ammonia: A Voronoi Polyhedra Analysis.
Journal of Physical Chemistry C 115, 9646 - 9652 (2011)
Impakt faktor: 3,603 - Jedlovszky Pál, Darvas Mária:
Számítógépes szimulációk - a határfelületek modellezésének új eszközei.
Magyar Kémikusok Lapja 65, 384 - 387 (2010) - A. Idrissi, I. Vyalov, P. Damay, M. Kiselev, Y. P. Puhovski, Jedlovszky Pál:
Local structure in sub- and supercritical CO2: A Voronoi polyhedra analysis study.
Journal of Molecural Liquids 153, 20 - 24 (2010)
Impakt faktor: 1,649 - M. Darvas, L. B. Pártay, Jedlovszky Pál, G. Horvai:
Computer simulation and ITIM analysis of the surface of water-methanol mixtures containing traces of water.
Journal of Molecural Liquids 153, 88 - 93 (2010)
Impakt faktor: 1,649 - M. Darvas, K. Pojják, G. Horvai, Jedlovszky Pál:
Molecular dynamics simulation and identification of truly interfacial molecules (ITIM) analysis of the liquid-vapor interface of dymethyl sulfoxide.
The Journal of Chemical Physics 132, 32767 - 32767 (2010)
Impakt faktor: 2,920 - M. Szőri, Jedlovszky Pál, M. Roeselová:
Water adsorption on hydrophilic and hydrophobic self-assembled monolayers as proxies for atmospheric surfaces. A grand canonical Monte Carlo simulation study..
Physical Chemistry Chemical Physics 12, 4604 - 4616 (2010)
Impakt faktor: 3,453 - M. Petitjean, Gy. Hantal, C. Chauvin, S. Le Calvé, P. N. M. Hoang, S. Picaud, Jedlovszky Pál:
Adsorption of Benzaldehyde at the Surface of Ice, Studiedby Experimental Method and Computer Simulation.
Langmuir 26, 9596 - 9606 (2010)
Impakt faktor: 4,268 - Jedlovszky Pál, G. Garberoglio, R. Vallauri:
Dynamical properties of supercooled water close to the liquid-liquid coexistence lines.
Journal of Physics: Condensed Matter 22, 32767 - 32767 (2010)
Impakt faktor: 3,332 - Gy. Hantal, M. Darvas, L. B. Pártay, G. Horvai, Jedlovszky Pál:
Molecular level properties of the free water surface and different organic liquid/water interfaces, as seen from ITIM analysis of computer simulation results.
Journal of Physics: Condensed Matter 22, 32767 - 32767 (2010)
Impakt faktor: 3,332 - M. Jorge, Jedlovszky Pál, M. N. D. S. Cordeiro:
A Critical Assessment of Methods for the Intrinsic Analysis of Liquid Interfaces: 1. Surface Site Distributions.
Journal of Physical Chemistry C 114, 11169 - 11179 (2010)
Impakt faktor: 4,520 - K. Pojják, M. Darvas, G. Horvai, Jedlovszky Pál:
Properties of the Liquid-Vapor Interface of Water-Dimethyl Sulfoxide Mixture. A Molecular Dinamics Simulation and ITIM Analysis Study.
Journal of Physical Chemistry C 114, 12207 - 12220 (2010)
Impakt faktor: 4,520 - M. Darvas, T. Gilányi, Jedlovszky Pál:
Adsorption of Poly(Ethylene-Oxide) at the Free Water Surface. A Computer Simulation Study.
Journal of Physical Chemistry B 114, 10995 - 11001 (2010)
Impakt faktor: 3,603 - Gy. Hantal, S. Picaud, P. N. M. Hoang, V. P. Voloshin, N. N. Medvedev, Jedlovszky Pál:
Water adsorption isotherms on porous onion-like carbonaceous particles. Simulations with the grand canonical Monte Carlo method.
The Journal of Chemical Physics 133, 32767 - 32767 (2010)
Impakt faktor: 2,920 - M. Jorge, Gy. Hantal, Jedlovszky Pál, M. N. D. S. Cordeiro:
A Critical Assessment of Methods for the Intrinsic Analysis of Liquid Interfaces: 2. Density Profiles.
Journal of Physical Chemistry C 114, 18656 - 18663 (2010)
Impakt faktor: 4,520 - L. B. Pártay, G. Horvai, Jedlovszky Pál:
Temperature and Pressure Dependence of the Properties of the Liquid-Liquid Interface. a Computer Simulation and Idetification of the Truly Interfacial Molecules Investigation of the Water-Benzene System.
Journal of Physical Chemistry C 114, 21681 - 21693 (2010)
Impakt faktor: 4,520 - M. Petitjean, M. Darvas, S. Le Calvé, Jedlovszky Pál, S. Picaud:
Adsorption of Hydroxyacetone on Pure Ice Surfaces.
ChemPhysChem 11, 3921 - 3927 (2010)
Impakt faktor: 3,339 - M. Darvas, S. Picaud, Jedlovszky Pál:
Molecular Dynamics Simulation of the Adsorption of Oxilac Acid on Ice Surface.
ChemPhysChem 11, 3971 - 3979 (2010)
Impakt faktor: 3,339 - P. L. Chau, Jedlovszky Pál, P. N. M. Hoang, S. Picaud:
Pressure reversal of general anaesthetics: A possible mechanism from molecular dynamics simulations.
Journal of Molecural Liquids 147, 128 - 134 (2009)
Impakt faktor: 1,278 - Jedlovszky Pál, M. Sega, R. Vallauri:
GM1 Ganglioside Embedded in Hydrated DOPC Membrane: A Molecular Dynamics Simulation Study.
Journal of Physical Chemistry B 113, 4876 - 4886 (2009)
Impakt faktor: 3,471 - Jedlovszky Pál, A. Idrissi, G. Jancsó:
Can Existing models qualitatively describe the mixing behavior of acetone-water mixtures?.
The Journal of Chemical Physics 130, 32767 - 32767 (2009)
Impakt faktor: 3,093 - M. Darvas, Jedlovszky Pál, G. Jancsó:
Free Energy of Mixing of Pyridine and its Methyl-Substituted Derivatives with Water, as Seen from Computer Simulations.
Journal of Physical Chemistry B 113, 7615 - 7620 (2009)
Impakt faktor: 3,471 - Jedlovszky Pál, A. Idrissi, G. Jancsó:
Response to \"Comment on \'Can Existing models qualitatively describe the mixing behavior of acetone-water mixtures?\'\".
The Journal of Chemical Physics 131, 32767 - 32767 (2009)
Impakt faktor: 3,093 - L.B. Pártay, Jedlovszky Pál, G. Horvai:
Structure of the Liquid-Vapor Interface of Water-Acetonitrile Mixtures as Seen from Molecural Dynamics Simulations and Truly Interfacial Molecules Analysis.
Journal of Physical Chemistry C 113, 18173 - 18183 (2009)
Impakt faktor: 4,224 - Gy. Hantal, P. Terleczky, G. Horvai, L. Nyulászi, Jedlovszky Pál:
Molecular Level Properties of the Water-Dichloromethane Liquid/Liquid Interface, as Seen from Molecular Dynamics Simulation and Idetification of Truly Interfacial Molecules Analysis.
Journal of Physical Chemistry C 113, 19263 - 19276 (2009)
Impakt faktor: 4,224 - E. Tombácz, A. Hajdú, E. Illés, K. László, G. Garberoglio, Jedlovszky Pál:
Water in Contact with Magnetite Nanoparticles, as Seen from Experiments and Computer Simulations.
Langmuir 25, 13007 - 13014 (2009)
Impakt faktor: 3,898 - L. B. Pártay, Gy. Hantal, Jedlovszky Pál, Á. Vincze, G. Horvai:
A new method for determining the interfacial molecules and characterizing the surface roughness in compputer simulations. Application to the liquid-vapor interface of water..
Journal of Computational Chemistry 29, 945 - 956 (2008)
Impakt faktor: 3,390 - L. B. Pártay, Jedlovszky Pál, Á. Vincze, G. Horvai:
Properties of Free Surface of Water-Methanol Mixtures. Analysis of the Truly Interfacial Molecular Layer in Computer Simulation.
Journal of Physical Chemistry B 112, 5428 - 5438 (2008)
Impakt faktor: 4,189 - Á. Vincze, Jedlovszky Pál, L. B. Pártay, G. Horvai:
Behavior of molecular oxygen at the liquid-liquid interface: A molecular dynamics simulation study.
Chemical Physics Letters 457, 78 - 81 (2008)
Impakt faktor: 2,169 - Jedlovszky Pál, Gy. Hantal, K. Neuróhr, S. Picaud, P. N. M. Hoang, P. von Hessberg, J. N. Crowley:
Adsorption Isotherm of Formic acid on the surface of Ice, as seen from Experiments and Grand Canonical Monte Carlo Simulation.
Journal of Physical Chemistry B 112, 8976 - 8987 (2008)
Impakt faktor: 3,396 - Jedlovszky Pál, L. B. Pártay, A. P. Bartók, V. P. Voloshin, N. N. Medvedev, G. Garberoglio, R. Vallauri:
Structural and thermodynamic properties of different phases of supercooled liqiud water.
The Journal of Chemical Physics 128, 32767 - 32767 (2008)
Impakt faktor: 3,149 - L. B. Pártay, G. Horvai, Jedlovszky Pál:
Molecular level structure of the liquid/liqiud interface. Molecular dynamics simulation and ITIM analysis of the water-CCl4 system.
Physical Chemistry Chemical Physics 10, 4754 - 4764 (2008)
Impakt faktor: 4,064 - L. B. Pártay, M. Sega, Jedlovszky Pál:
A Two-step Aggregation Scheme of Bile Acid Salts, as Seen from Computer Simulations.
Progress in Colloid Polymer Science 135, 181 - 32767 (2008) - L. B. Pártay, M. Sega, Jedlovszky Pál:
Counterion Binding in Aqueous Solutions of Bile Acid Salts, as Studied by Computer Simulation Methods.
Langmuir 24, 10729 - 10736 (2008)
Impakt faktor: 4,097 - Gy. Hantal, P.N.M. Hoang, S. Picaud, Jedlovszky Pál:
Investigation of the adsorption behavior of acetone at the surface of ice.
Physical Chemistry Chemical Physics 10, 6369 - 6380 (2008)
Impakt faktor: 4,064 - Jedlovszky Pál, A. Idrissi:
Hydration free energy difference of acetone, acetamidea and urea.
Journal Physical Chemistry 129, 32767 - 32767 (2008)
Impakt faktor: 3,149 - A. Idrissi, P. Damay, K. Yukichi, Jedlovszky Pál:
Self-association of urea in aqueous solutions: A Voronoi polyhedron analysis study.
Journal Physical Chemistry 129, 32767 - 32767 (2008)
Impakt faktor: 3,149 - F. Moulin, S. Picaud, P. N. M. Hoang, L. B. Pártay, Jedlovszky Pál:
A grand canonical Monte Carlo simulation of the aggregation of water molecules on chemically modified soot particles.
Computing Letters 4, 105 - 1016 (2008) - Gy. Hantal, Jedlovszky Pál, L. B. Pártay, S. Picaud, P. N. M. Hoang:
Molecular-scale Modeling of the Adsorption of Partially Oxidized Organic Compounds on Ice.
Trends in Physical Chemistry 13, 1 - 18 (2008) - Jedlovszky Pál, L. Pártay, M. Mezei:
The structure of the zwitterionic headgroups in a DMPC bilayer as seen from Monte Carlo simulation; comparisons with ionic solutions.
Journal of Molecural Liquids 131-132, 225 - 234 (2007)
Impakt faktor: 0,982 - Gy. Hantal, L. B. Pártay, I. Varga, Jedlovszky Pál, T. Gilányi:
Counterion and Surface Density Dependence of the Adsorption Layer of Ionic Surfactants at the Air/Aqueous Solution Interface. A Computer Simulation Study.
Journal of Physical Chemistry B 111, 1769 - 1774 (2007)
Impakt faktor: 4,086 - L. B. Pártay, Jedlovszky Pál, I. Brovchenko, A. Oleinikova:
Formation of mesoscopic water networks in aqueous systems.
Physical Chemistry Chemical Physics 9, 1341 - 1346 (2007)
Impakt faktor: 3,343 - L. B. Pártay, Jedlovszky Pál, G. Horvai:
Temperature dependence of the structure of the liquid-vapour interface of aqueous methanol solutions.
Journal of Molecural Liquids 134, 111 - 119 (2007)
Impakt faktor: 0,982 - P. L. Chau, P. N. M. Hoang, S. Picaud, Jedlovszky Pál:
A possible mechanism for pressure reversal of general anaesthetics from molecular simulations.
Chemical Physics Letters 438, 294 - 297 (2007)
Impakt faktor: 2,207 - Jedlovszky Pál, L. B. Pártay:
Adsorption of Octyl Cyanide at the Free Water Surface as Studied by Monte Carlo Simulation.
Journal of Physical Chemistry B 111, 5885 - 5895 (2007)
Impakt faktor: 4,086 - Jedlovszky Pál, L. B. Pártay, A. P. Bartók, G. Garberoglio, R. Vallauri:
Structure of coexisting liquid phases of supercooled water: Analogy with ice polymorphs.
The Journal of Chemical Physics 126, 32767 - 32767 (2007)
Impakt faktor: 3,044 - L. B. Pártay, Jedlovszky Pál, I. Brovchenko, A. Oleinikova:
Percoaltion Transition in supercritical Water. A Monte Carlo Simulation Study..
Journal of Physical Chemistry B 111, 7603 - 7609 (2007)
Impakt faktor: 4,086 - L. B. Pártay, Jedlovszky Pál, P. N. M. Hoang, S. Picaud, M. Mezei:
Free Energy Profile of Small Molecules at the Free Surfaces of Water and Ice, as Determinated by Cavity Insertion Widom Calculations.
Journal of Physical Chemistry C 111, 9407 - 9416 (2007)
Impakt faktor: 4,086 - Jedlovszky Pál, L. B. Pártay, M. Sega:
Molecular Aggregates in Aqueous Solutions of Bile Acid Salts. Molecular Dynamics Simulation Study.
Journal of Physical Chemistry B 111, 9886 - 9896 (2007)
Impakt faktor: 4,086 - Gy. Hantal, Jedlovszky Pál, P. N. M. Hoang, S. Picaud:
Calculation of the Adsorption Isotherm of Formadehyde on Ice by Grand Canonical Monte Carlo Simulation.
Journal of Physical Chemistry B 111, 14170 - 14178 (2007)
Impakt faktor: 4,086 - Jedlovszky Pál, L. B. Pártay:
Investigation of the saturated adsorption layer of 5-cyano-biphenyl and 5-cyano-terphenyl at the free water surface by Monte Carlo simulation.
Journal of Molecural Liquids 136, 249 - 256 (2007)
Impakt faktor: 0,982 - F. Moulin, S. Picaud, P. N. M. Hoang, Jedlovszky Pál:
Grand canonical Monte Carlo simulation of the adsorption isotherms of water molecules on model soot particles.
The Journal of Chemical Physics 127, 32767 - 32767 (2007)
Impakt faktor: 3,044 - L. B. Pártay, M. Sega, Jedlovszky Pál:
Morphology of Bile Salt Micelles, as Studies by Computer simulation Methods.
Langmuir 23, 12322 - 12328 (2007)
Impakt faktor: 4,009 - L. Pártay, Jedlovszky Pál, G. Jancsó:
Orientation of the 3-methylpyridine molecules at the liquid-vapour interface of their aqueous solution.
Chemical Physics Letters 420, 367 - 371 (2006)
Impakt faktor: 2,462 - L. Pártay, Jedlovszky Pál, R. Vallauri:
Development of a new polarizable potential model of hydrogen fluoride and comparison with other effective models in liquid and supercritical states.
The Journal of Chemical Physics 124, 32767 - 32767 (2006)
Impakt faktor: 3,166 - Jedlovszky Pál, M. Predota, I. Nezbeda:
Hydration of apolar soluted of varying size. A systematic study.
Molecular Physics 104, 2465 - 2476 (2006)
Impakt faktor: 1,690 - F. Moulin, S. Picaud, P. N. M. Hoang, L. Pártay, Jedlovszky Pál:
A grand canonical Monte Carlo simulation study of water adsorption on a model soot particle.
Molecular Simulation 32, 487 - 493 (2006)
Impakt faktor: 1,084 - M. Sega, Jedlovszky Pál, R. Vallauri:
Molecular dynamics simulation of GM1 gangliosides embedded in a phospholipid membrane.
Journal of Molecural Liquids 129, 86 - 91 (2006)
Impakt faktor: 1,106 - Jedlovszky Pál, L. Pártay, P. N. M. Hoang, S. Picaud, P. von Hessberg, J. N. Crowley:
Determination of the Adsorption Isotherm of Methanol on the Surface of Ice. An Experimental and Grand Canonical Monte Carlo Simulation Study.
Journal of the American Chemical Society 128, 15300 - 15309 (2006)
Impakt faktor: 7,696 - Jedlovszky Pál, Á. Keresztúri, G. Horvai:
Orientational order of the water molecules at the vicinity of the water-benzene interface in a broad range of thermodynamic states, as seen from Monte Carlo simulations.
Faraday Discuss 129, 35 - 46 (2005)
Impakt faktor: 3,652 - Jedlovszky Pál, R. Vallauri:
Liquid-vapor and liquid.liquid phase equilibria of the Brodholt-Sampoli-Vallauri polarizable water model.
The Journal of Chemical Physics 122, 32767 - 32767 (2005)
Impakt faktor: 3,138 - A. L. Rabinovich, N. K. Balabaev, M. G. Alinchenko, V. P. Voloshin, N. N. Medvedev, Jedlovszky Pál:
Computer simulation study of intermolecular voids in various unsaturated phosphatidylcholine lipid bilayers.
The Journal of Chemical Physics 122, 32767 - 32767 (2005)
Impakt faktor: 3,138 - A. Paszternák, É. Kiss, Jedlovszky Pál:
Aggragation properties of the nonionic surfactant C8E3 in bulk water and at the free water surface.
The Journal of Chemical Physics 122, 32767 - 32767 (2005)
Impakt faktor: 3,138 - L. Pártay, Jedlovszky Pál, G. Jancsó:
Calculation of the Hydration Free Energy Difference Between Pyridine and its Methyl-Substituted Derivatives by Computer Simulation Methods.
Journal of Physical Chemistry B 109, 8097 - 8102 (2005)
Impakt faktor: 4,033 - L. Pártay, Jedlovszky Pál, G. Horvai:
The Structure of the Acetone Liquid-Vapor Interface as seen from Monte Carlo Simulations.
Journal of Physical Chemistry B 109, 12014 - 12019 (2005)
Impakt faktor: 4,033 - L. Pártay, Jedlovszky Pál:
Line of percolation in supercritical water.
The Journal of Chemical Physics 123, 24502 - 24502 (2005)
Impakt faktor: 3,138 - M. G. Alinchenko, V. P. Voloshin, N. N. Medvedev, M. Mezei, L. Pártay, Jedlovszky Pál:
Effect of Cholesterol on the Properties of Phospholipid Membranes. 4. Interatomic Voids.
Journal of Physical Chemistry B 109, 16490 - 16502 (2005)
Impakt faktor: 4,033 - Á. Keresztúri, Jedlovszky Pál:
Computer simulation investigation of the water-benzene interface in a broad range of thermodynamic states from ambient to supercritical conditions.
Journal of Physical Chemistry B 109, 16782 - 16793 (2005)
Impakt faktor: 4,033 - L. Pártay, Jedlovszky Pál, Á. Vincze, G. Horvai:
Structure of the Liqiud-Vapor Interface if Water-Methanol Mixtures as Seen from onte Carlo Simulations.
Journal of Physical Chemistry B 109, 20493 - 20503 (2005)
Impakt faktor: 4,033 - Jedlovszky Pál, Á. Vincze, G. Horvai:
Properties of water/apolar interfaces seen from Monte Carlo simulations.
Journal of Molecural Liquids 109, 99 - 108 (2004)
Impakt faktor: 1,057 - Jedlovszky Pál, N.N. Medvedev, M. Mezei:
Effect of Cholesterol on the Properties of Phospholipid Membranes. 3. Local Lateral Structure.
Journal of Physical Chemistry B 108, 465 - 472 (2004)
Impakt faktor: 3,834 - Jedlovszky Pál, Á. Vincze, G. Horvai:
Full description of the orientational statistics of molecules near to interfaces. Water at the interface with CCl4.
Physical Chemistry Chemical Physics 6, 1874 - 1879 (2004)
Impakt faktor: 2,076 - Jedlovszky Pál, I. Varga, T. Gilányi:
Adsorption of 1-octanol at the free water surface as studied by Monte Carlo simulation.
The Journal of Chemical Physics 120, 11839 - 11851 (2004)
Impakt faktor: 3,105 - M. Sega, Jedlovszky Pál, N. N. Medvedev, R. Vallauri:
Free volume properties of a linear soft polymer. A computer simulation study.
The Journal of Chemical Physics 121, 2422 - 2427 (2004)
Impakt faktor: 3,105 - Jedlovszky Pál:
The hydrogen bonding structure of water at the vicinity of apolar interfaces. A computer simulation study.
Journal of Physics: Condensed Matter 16, 5389 - 5402 (2004)
Impakt faktor: 2,049 - M. G. Alinchenko, A. V. Anikeenko, N. N. Medvedev, V. P. Voloshin, M. Mezei, Jedlovszky Pál:
Morphology of Voids in Molecular Systems. A Voronoi-Delaunay Analysis of a Simulated DMPC Membrane.
Journal of Physical Chemistry B 108, 19056 - 19067 (2004)
Impakt faktor: 3,834 - Jedlovszky Pál, R. Vallauri:
Temperature of maximum density line of a polarizable water model.
PHYSICAL REVIEW E 67, 11201 - 11201 (2003)
Impakt faktor: 2,202 - Jedlovszky Pál, M. Mezei:
Effect of Cholesterol on the Properties of Phospholipid Membranes. 1. Structural Features.
Journal of Physical Chemistry B 107, 5311 - 5321 (2003)
Impakt faktor: 3,679 - Jedlovszky Pál, M. Mezei:
Effect of Cholesterol on the Properties of Phospholipid Membranes. 2. Free Energy Profile of Small Molecules.
Journal of Physical Chemistry B 107, 5322 - 5332 (2003)
Impakt faktor: 3,679 - Jedlovszky Pál, I. Varga, T. Gilányi:
Adsorption of apolar molecules at the water liquid/vapor interface. A Monte Carlo simulation study of the water - n-octane system.
The Journal of Chemical Physics 119, 1731 - 1740 (2003)
Impakt faktor: 2,950 - Jedlovszky Pál, Á. Vincze, G. Horvai:
New insight into the orientational order of water molecules at the water/1,2-dichloroethane interface: A Monte Carlo simulation study.
The Journal of Chemical Physics 117, 2271 - 2280 (2002)
Impakt faktor: 2,988 - M. Fuxreiter, N. Luo, Jedlovszky Pál, I. Simon, R. Osman:
Role of Base Flipping in Specific Recognition of Damaged DNA by Repair Enzymes.
Journal of Molecular Biology 323, 823 - 834 (2002)
Impakt faktor: 5,359 - Jedlovszky Pál, M. Mezei:
Orientation Order of the Water Molecules Across a Fully Hydrated DMPC Bilayer.
Journal of Physical Chemistry B 105, 3614 - 3623 (2001)
Impakt faktor: 3,379 - Jedlovszky Pál, R. Vallauri:
Thermodynamic and structural properties of liquid water around the temperature of maximum density in a wide range of pressures. Computer simulation study with a polarizable potential model.
The Journal of Chemical Physics 115, 3750 - 3762 (2001)
Impakt faktor: 3,147 - Jedlovszky Pál, M. Mezei, R. Vallauri:
Comparison of polarizable and nonpolarizable models of hydrogen flouride in liquid and supercritical states. A Monte Carlo simulation study.
The Journal of Chemical Physics 115, 9883 - 9894 (2001)
Impakt faktor: 3,147 - Á. Vincze, Jedlovszky Pál, G. Horvai:
The L/L interface and adsorption of SCN- anions as studies by different molecural simulation techniques.
Analytical Sciences 17, 317 - 320 (2001)
Impakt faktor: 0,916 - Jedlovszky Pál, M .Mezei, R. Vallauri:
A molecural level explanation of the density maximum of liquid water from computer simulations with a polarizable potential model.
Chemical Physics Letters 318, 155 - 160 (2000)
Impakt faktor: 2,364 - Jedlovszky Pál, R. Vallauri, J. Richardi:
The change of the structural and thermodynamic properties of water from ambient to supercritical conditions as seen by computer simulation.
Journal of Physics: Condensed Matter 12, 115 - 122 (2000)
Impakt faktor: 1,608 - Jedlovszky Pál, M. Mezei:
Calculation of the free energy profile of H2O, O2, CO, CO2, NO and CHCl3 in a lipid bilayer with a cavity insertion variant of the Widom method.
Journal of the American Chemical Society 122, 5125 - 5135 (2000)
Impakt faktor: 6,025 - U. Balucani, J. P. Brodholt, Jedlovszky Pál, R. Vallauri:
The shear viscosity of liquid water from computer simulations with a polarizable potential model.
PHYSICAL REVIEW E 62, 2971 - 2973 (2000)
Impakt faktor: 2,142 - P. Mináry, Jedlovszky Pál, M. Mezei, L. Turi:
A Comprehensive Liquid Simulation Study of Neat Formic Acid.
Journal of Physical Chemistry B 104, 8287 - 8294 (2000)
Impakt faktor: 3,386 - J. Richardi, Jedlovszky Pál, P. H. Fries, C. Millot:
Can the molecural Ornstein-Zernike theory be used to study H-bonding water under supercritical conditions?.
Journal of Molecural Liquids 87, 177 - 189 (2000)
Impakt faktor: 0,829 - Jedlovszky Pál, I. Bakó, G. Pálinkás:
Molecural clusters in liquid methanol: a reverse Monte Carlo study.
Journal of Molecural Liquids 87, 243 - 254 (2000)
Impakt faktor: 0,829 - Jedlovszky Pál:
The local structure of various hydrogen bonded liquids: Voronoi polyhedra analysis of water, methanol and HF.
The Journal of Chemical Physics 113, 9113 - 9121 (2000)
Impakt faktor: 3,301 - Jedlovszky Pál, M . Mezei:
The anisotropic virial-biased sampling for simulations in the isobaric-isothermal ensemble.
Molecular Physics 96, 293 - 296 (1999)
Impakt faktor: 1,774 - Jedlovszky Pál, M. Mezei:
Computer simulation study of liquid CH2F2 with a new effective pair potential model.
The Journal of Chemical Physics 110, 2991 - 3002 (1999)
Impakt faktor: 3,289 - Jedlovszky Pál, J. Richardi:
Comparison of different water models from ambient to supercritical conditions: a Monte carlo simulation and Ornstein-Zernike study.
The Journal of Chemical Physics 110, 8019 - 8031 (1999)
Impakt faktor: 3,289 - Jedlovszky Pál:
Voronoi polyhedra analysis of the local structure of water from ambient to supercritical conditions.
The Journal of Chemical Physics 111, 5975 - 5985 (1999)
Impakt faktor: 3,289 - Jedlovszky Pál, R. Vallauri:
Temperature dependence of thermodynamic properties of a polarizable potential model of water.
Molecular Physics 97, 1157 - 1163 (1999)
Impakt faktor: 1,774 - Jedlovszky Pál, M. Mezei:
Monte Carlo simulation of a lipid bilayer in the grand canonical ensemble using extension biased rotation.
The Journal of Chemical Physics 111, 10770 - 10773 (1999)
Impakt faktor: 3,289 - Jedlovszky Pál, R. Vallauri:
Structural properties of liquid HF: a computer simulation investigation.
Molecular Physics 93, 15 - 24 (1998)
Impakt faktor: 1,854 - Jedlovszky Pál:
Investigation of the orientational correlation of the molecules in liquid H2S with reverse Monte Carlo simulation.
Molecular Physics 93, 939 - 946 (1998)
Impakt faktor: 1,854 - Jedlovszky Pál, J. P. Brodholt, F. Bruni, M. A. Ricci, A. K. Soper, R. Vallauri:
Analysis of the hydrogen bonded structure of water from ambient to supercritical conditions.
The Journal of Chemical Physics 108, 8528 - 8540 (1998)
Impakt faktor: 3,147 - Jedlovszky Pál, L. Turi:
A new five-site pair potential for formic acid in liquid simulations.
Journal of Physical Chemistry A 101, 2662 - 2665 (1997)
Impakt faktor: 3,392 - Jedlovszky Pál, L. Turi:
Role of the C-H...O Hydrogen Bonds in Liquids: a Monte Carlo Simulation study of Liquid Formic acid Using a Newly Developed Pair Potential.
Journal of Physical Chemistry B 101, 5429 - 5436 (1997)
Impakt faktor: 3,392 - Jedlovszky Pál:
Structural study of liquid methylene chloride with reverse Monte Carlo simulation.
The Journal of Chemical Physics 107, 562 - 570 (1997)
Impakt faktor: 3,247 - Jedlovszky Pál:
Orientation correlation in liquid and amorphous carbon tetrachloride: a reverse Monte Carlo study.
The Journal of Chemical Physics 107, 7433 - 7442 (1997)
Impakt faktor: 3,247 - Jedlovszky Pál, R. Vallauri:
Computer simulation study of liquid HF with a new effective pair potential model.
Molecular Physics 92, 331 - 336 (1997)
Impakt faktor: 1,700 - Jedlovszky Pál, R. Vallauri:
Computer simulations of liquid HF by a newly developed polarizable potential model.
The Journal of Chemical Physics 107, 10166 - 10176 (1997)
Impakt faktor: 3,247 - T. Radnai, I. Bakó, Jedlovszky Pál, G. Pálinlás:
Local order in some aprotic dipolar liquids.
Molecular Simulation 16, 345 - 358 (1996)
Impakt faktor: 1,162 - Jedlovszky Pál, I. Bakó, G. Pálinkás, T. Radnai, A. K. Soper:
Investigation of the uniqueness of the reverse Monte Carlo method: Studies on liquid water.
The Journal of Chemical Physics 105, 245 - 254 (1996)
Impakt faktor: 3,516 - Jedlovszky Pál, R. Vallauri:
Reverse Monte Carlo analysis of neutron diffraction results: Water around its critical point.
The Journal of Chemical Physics 105, 2391 - 2398 (1996)
Impakt faktor: 3,516 - Jedlovszky Pál, G. Pálinkás:
Monte Carlo simulation of liquid acetone with a polarizable molecural model.
Molecular Physics 84, 217 - 233 (1995)
Impakt faktor: 1,827 - Jedlovszky Pál, I. Bakó, G. Pálinkás, J. C. Dore:
Structural investigation of liquid formic acid: X-ray and neutron diffraction and reverse Monte Carlo study.
Molecular Physics 86, 87 - 105 (1995)
Impakt faktor: 1,827 - Jedlovszky Pál, I. Bakó, G. Pálinkás:
Reverse Monte Carlo simulation of liquid water.
Chemical Physics Letters 221, 183 - 187 (1994)
Impakt faktor: 2,614 - T. Radnai, Jedlovszky Pál:
Reverse Monte Carlo Simulation of a Heteronuclear Molecular Liquid: Structural Study of Acetonitrile.
Journal of Physical Chemistry 98, 5994 - 6002 (1994)
Impakt faktor: 3,395 - G. Pálinkás, Jedlovszky Pál:
Network of strongly interacting atoms in liquid argon.
Chemical Physics Letters 185, 173 - 178 (1994)
Impakt faktor: 1,867 - T. Radnai, I. Bakó, Jedlovszky Pál, G. Pálinkás:
A reverse Monte Carlo and RISM integral equation study of liquid nitrogen.
Molecular Physics 83, 459 - 470 (1994)
Impakt faktor: 1,923 - Jedlovszky Pál, I. Bakó, G. Pálinkás, J. C. Dore:
Investigation of the structure of liquid formic acid.
NATO ASI Series 435, 119 - 127 (1994) - Gy. Inzelt, Jedlovszky Pál, K. Martinusz, P. Hudáky:
Application of a quartz-crystal microbalance in the study of ion and solvent sorption in polymer film electrodes I..
Acta Chimica Hungarica 128, 797 - 805 (1991)
Impakt faktor: 0,111
Konferenciacikk
- S. Picaud, P. N. M. Hoang, L. B. Pártay, Gy. Hantal, Jedlovszky Pál:
Molecural dynamics and Monte Carlo simulations of organic compounds adsorbed on ice surfaces.
ICCMSE Conference Proseedings, CP963, Vol. 1., 296 - 307 (2007)
Computational Methods in Science and Engineering
Rhodos, Görögország, 2007.08.28 - 2007.08.31. - A. V. Anikeenko, M. G. Alinchenko, V. P. Voloshin, N. N. Medvedev, Jedlovszky Pál, M. L. Gavrilova:
Implementation of the Voronoa-Delaunay Method for Analysis of Intermolecular Voids.
Proseedings of the 4th Workshop of Computational Geometry and Applications, 217 - 226 (2004)
4th Workshop of Computational Geometry and Appllications
Montreal, Egyesült Államok, 2004.06.12 - 2004.06.15. - Jedlovszky Pál, R. Vallauri:
Investigation of the thermodynamic properties of a polarizable water model in a wide range of pressures around the temperature of maximum density.
NATO Science Series, 47 - 57 (2002)
Liquids Under Negative Pressure
Budapest, Magyarország, 2002.02.03 - 2002.02.05.
Konferencia előadás
- Jedlovszky Pál:
Fluid határfelületek modellezése számítógépes szimulációval .
MKE 1. Nemzeti Konferencia
Sopron, Magyarország, 2011.05.22 - 2011.05.25. - Jedlovszky Pál:
Adsorption of Small Partially Oxidized Hydrocarbons at the Surface of Ice, As Seen by Computer Simulations .
242nd ACS National Meeting
Denver, Egyesült Államok, 2011.08.28 - 2011.09.01. - Jedlovszky Pál:
Structural and thermodynamic properties of different phases of supercooled liquid water; analogy with ice polymorphs.
EMLG Annual Conference 2011
Varsói Egyetem, Varsó, Lengyelország, 2011.09.11 - 2011.09.15. - Jedlovszky Pál:
Structural and thermodynamic properties of different phases of supercooled liquid water; analogy with ice polymorphs.
CECAM Workshop on Models for Bulk, Confined Water and Aqueous Solutions Upon Supercooling
EPFL, Lausanne, Svájc, 2011.07.04 - 2011.07.06. - Jedlovszky Pál:
Structural and thermodynamic properties of different phases of supercooled liquid water; analogy with ice polymorphs. .
8th LIBLICE CONFERENCE on the Statistical Mechanics of Liquids
Brno, Csehország, 2010.06.13 - 2010.06.18. - Jedlovszky Pál:
Fluid határfelületek modellezése számítógépes szimulációval.
Számítógépes matematikai módszerek alkalmazása a kémiában (MTA Kémiai Tud. Oszt.)
Budapest, Magyarország, 2010.05.07. - Jedlovszky Pál:
A new method for determining the interfacial molecules in computer simulations. Application to liquid-vapor and liquid-liquid interfaces.
CECAM Workshop on Modeling and Simulation of Water at Interfaces from Ambient to Supercooled Conditi
Lausanne, Svájc, 2009.06.29 - 2009.07.01. - Jedlovszky Pál:
A new method for determining the interfacial molecules in computer simulations. Application to liquid-vapor and liquid-liquid interfaces.
23rd Conference of the European Colloid and Interface Society
Antalya, Törökország, 2009.09.06 - 2009.09.11. - Jedlovszky Pál:
EPESAVSZÁRMAZÉKOK VIZES OLDATAINAK VIZSGÁLATA SZÁMÍTÓGÉPES SZIMULÁCIÓS MÓDSZEREKKEL .
Eötvös Konferencia 2009
Budapest, Magyarország, 2009.09.30. - Jedlovszky Pál:
Molecular Aggregates in the Aqueous Solutions of Bile Acid Salts. .
EMLG Annual Meeting 2008
Liszabon, Portugália, 2008.08.31 - 2008.09.04. - Jedlovszky Pál:
The Reverse Monte Carlo (RMC) method.
IX-th school of neutron scattering “Francesco Paolo Ricci”
Santa Margherita di Pula, Olaszország, 2008.09.22 - 2008.10.03. - Jedlovszky Pál:
Molekulák orientációja folyadék/gőz, folyadék/folyadék illetve szilárd/gáz határfelületen.
MTA Kolloidkémiai Munkabizottság
Siófok, Magyarország, 2007.05.24 - 2007.05.25. - Jedlovszky Pál:
Free Energy Profile of Small Solute Molecules at the Free Surfaces of Water and Ice, as Determined by Cavity Insertion Widom Calculations .
Thermodynamics 2007
Rueil-Malmaison, Franciaország, 2007.09.26 - 2007.09.28. - Jedlovszky Pál:
Adsorption Isotherm of Partially Oxidized Methane Derivatives at the Surface of Ice, As Seen from Computer Simulation .
9th Conference on Colloid Chemistry
Siófok, Magyarország, 2007.10.03 - 2007.10.05. - Jedlovszky Pál:
Structure of the liquid-vapor interface of polar liquids and their aqueous solutions.
20th Conference of the European Colloid and Interface Society
Budapest, Magyarország, 2006.09.17 - 2009.09.22. - Jedlovszky Pál:
Orientational Ordering of the molecules at Liquid-Liquid and Liquid-Vapor Interfaces.
EMLG Annual Meeting 2006
Barcelona, Spanyolország, 2006.09.03 - 2006.09.07. - Jedlovszky Pál:
Structure of the Liquid-Vapor Interface of Polar Liquids and Their Aqueous Solutions.
EMLG Annual Meeting 2005
Prága, Csehország, 2005.09.04 - 2005.09.08. - Jedlovszky Pál:
Structure of the Liquid-Vapor Interface of Polar Liquids and Their Aqueous Solutions.
29th International Conference on Solution Chemistry
Portoroz, Szlovénia, 2005.08.21 - 2005.08.25. - Jedlovszky Pál:
A túlhűtött víz anomális tulajdonságainak értelmezése számítógépes szimulációval.
Pro Scientia Aranyérmesek VII. Tudományos Konferenciája
Gödöllő, Magyarország, 2004.11.24 - 2004.11.28. - Jedlovszky Pál:
Foszfolipid-koleszterin elegy membránok számítógépes szimulációs vizsgálata.
Magyary Zoltán és OTKA Posztdoktori Ösztöndíjasok Konferenciája
Debrecen, Magyarország, 2004.11.11 - 2004.11.12. - Jedlovszky Pál:
Orientational order of the water molecules at the vicinity of the water-benzene interface in a broad range of thermodynamic states, as seen from Monte Carlo simulations .
Faraday Discussions129
Cambridge, Egyesült Királyság, 2004.09.01 - 2004.09.03. - Jedlovszky Pál:
Lipid-koleszterin elegy membránok számítógépes szimulációs vizsgálata.
Kutatási Ösztöndíjasok Fóruma, MTA Kémiai Osztálya
Budapest, Magyarország, 2003.11.04. - Jedlovszky Pál:
Orientation of water at the liquid-liquid interface.
436 International Bunsen Discussion Meeting
Velen, Németország, 2003.09.19 - 2003.09.23. - Jedlovszky Pál:
Investigation of the thermodynamic properties of a polarizable water model in a wide range of pressure around the temperature of maximum density.
Liquids Under Negative Pressure
Budapest, Magyarország, 2002.02.03 - 2002.02.05. - Jedlovszky Pál:
Comparison of polarizable and nonpolarizable models of hydrogen fluoride in liquid and supercritical states. A Monte Carlo simulation study.
EMLG Annual Meeting 2002
Rodosz, Görögország, 2002.09.07 - 2009.09.15. - Jedlovszky Pál:
Lipid membránok szerkezetének vizsgálata számítógépes szimulációval.
Pro Scientia Aranyérmesek V. Konferenciája
Sopron, Magyarország, 2000.11.05 - 2000.11.07. - Jedlovszky Pál:
The change of the structural and thermodynamic properties of water from ambient to supercritical conditions as seen by computer simulations.
4th Liquid Matter Conference
Granada, Spanyolország, 1999.07.03 - 1999.07.07. - Jedlovszky Pál:
Computer simulation study of liquid HF with newly developed potential models.
Liquid State Theory Conference of the NATO ASI
Patti Marina, Olaszország, 1998.07.07 - 1998.07.17. - Jedlovszky Pál:
A víz szerkezetének változása szobahőmérséklettől a kritikus pontig.
Pro Scientia Aranyérmesek IV. Konferenciája
Szeged, Magyarország, 1998.11.06 - 1998.11.07. - Jedlovszky Pál:
Hidrogénkötéses folyadékok szerkezete.
Pro Scientia Aranyérmesek III. Konferenciája
Debrecen, Magyarország, 1996.11.07 - 1996.11.09. - Jedlovszky Pál:
Rendezetlen rendszerek szerkezetének vizsgálata Reverse Monte Carlo módszerrel.
Pro Scientia Aranyérmesek II. Konferenciája
Budapest, Magyarország, 1994.11.08 - 1994.11.11. - Jedlovszky Pál:
Folyadékok szerkezetének vizsgálata.
Pro Scientia Aranyérmesek I Konferenciája
Budapest, Magyarország, 1992.11.08 - 1992.11.11.
A weboldal az EKF a TermészetTudás Főiskolája címet viselő, az Új Magyarország Fejlesztési Terv TÁMOP 4.2.3 Tudományos eredmények elismerése és disszeminációja című pályázatán elnyert projekt részeként valósul meg.
A projekt az Európai Unió támogatásával, az Európai Szociális Alap társfinanszírozásával valósul meg.
Készítette: Juhász Tibor
© 2010 Eszterházy Károly Főiskola. Minden jog fenntartva.