Laszlo Pusztai
Laszlo Pusztai
Wigner RCP, Budapest (Hungary); IROAST, Kumamoto University (Japan)
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Reverse Monte Carlo simulation: a new technique for the determination of disordered structures
RL McGreevy, L Pusztai
Molecular simulation 1 (6), 359-367, 1988
A new version of the RMC++ Reverse Monte Carlo programme, aimed at investigating the structure of covalent glasses
O Gereben, P Jóvári, L Temleitner, L Pusztai
Journal of optoelectronics and advanced materials 9 (10), 3021, 2007
Reverse Monte Carlo modelling of the structure of disordered materials with RMC++: a new implementation of the algorithm in C++
G Evrard, L Pusztai
Journal of Physics: Condensed Matter 17 (5), S1, 2005
The structure of molten salts
RL McGreevy, L Pusztai
Proceedings of the Royal Society of London. Series A: Mathematical and …, 1990
Structure of amorphous semiconductors: Reverse Monte Carlo studies on a-C, a-Si, and a-Ge
O Gereben, L Pusztai
Physical Review B 50 (19), 14136, 1994
Structure of evaporated pure amorphous silicon: Neutron-diffraction and reverse Monte Carlo investigations
S Kugler, L Pusztai, L Rosta, P Chieux, R Bellissent
Physical Review B 48 (10), 7685, 1993
On the accurate calculation of the dielectric constant from molecular dynamics simulations: The case of SPC/E and SWM4-DP water
O Gereben, L Pusztai
Chemical Physics Letters 507 (1-3), 80-83, 2011
RMC_POT: A computer code for reverse monte carlo modeling the structure of disordered systems containing molecules of arbitrary complexity
O Gereben, L Pusztai
Journal of computational chemistry 33 (29), 2285-2291, 2012
MCGR: An inverse method for deriving the pair correlation function from the structure factor
L Pusztai, RL McGreevy
Physica B: Condensed Matter 234, 357-358, 1997
Hydrogen bonding and molecular aggregates in liquid methanol, ethanol, and 1-propanol
A Vrhovsek, O Gereben, A Jamnik, L Pusztai
The Journal of Physical Chemistry B 115 (46), 13473-13488, 2011
Partial pair correlation functions of liquid water
L Pusztai
Physical Review B 60 (17), 11851, 1999
Determination of Three Body Correlations in Simple Liquids by RMC Modelling of Diffraction Data. II. Elemental Liquids
MA Howe, RL McGreevy, L Pusztai, I Borzsák
Physics and Chemistry of Liquids 25 (4), 205-241, 1993
Investigation of the structure of ethanol–water mixtures by molecular dynamics simulation I: analyses concerning the hydrogen-bonded pairs
O Gereben, L Pusztai
The Journal of Physical Chemistry B 119 (7), 3070-3084, 2015
The structure of liquid tetrachlorides and
P Jóvári, G Mészáros, L Pusztai, E Sváb
The Journal of Chemical Physics 114 (18), 8082-8090, 2001
Understanding the structure of aqueous cesium chloride solutions by combining diffraction experiments, molecular dynamics simulations, and reverse monte carlo modeling
V Mile, L Pusztai, H Dominguez, O Pizio
The Journal of Physical Chemistry B 113 (31), 10760-10769, 2009
Lead silicate glasses: Binary network-former glasses with large amounts of free volume
S Kohara, H Ohno, M Takata, T Usuki, H Morita, K Suzuya, J Akola, ...
Physical Review B 82 (13), 134209, 2010
On the structure of aqueous solutions
I Harsányi, L Pusztai
The Journal of chemical physics 122 (12), 124512, 2005
On the uniqueness of the Reverse Monte Carlo simulation. I. Simple liquids, partial radial distribution functions
L Pusztai, G Tóth
The Journal of chemical physics 94 (4), 3042-3049, 1991
Comparison of interaction potentials of liquid water with respect to their consistency with neutron diffraction data of pure heavy water
L Pusztai, O Pizio, S Sokolowski
The Journal of chemical physics 129 (18), 184103, 2008
The Roles of the Ge‐Te Core Network and the Sb‐Te Pseudo Network During Rapid Nucleation‐Dominated Crystallization of Amorphous Ge2Sb2Te5
K Ohara, L Temleitner, K Sugimoto, S Kohara, T Matsunaga, L Pusztai, ...
Advanced Functional Materials 22 (11), 2251-2257, 2012
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