Nanometer range correlations between molecular orientations in liquids of molecules with perfect tetrahedral shape: CCl4, SiCl4, GeCl4, and SnCl4 S Pothoczki, L Temleitner, P Jóvári, S Kohara, L Pusztai The Journal of chemical physics 130 (6), 2009 | 46 | 2009 |
Variations of the hydrogen bonding and hydrogen-bonded network in ethanol–water mixtures on cooling S Pothoczki, L Pusztai, I Bakó The Journal of Physical Chemistry B 122 (26), 6790-6800, 2018 | 40 | 2018 |
Molecular dynamics simulation studies of the temperature-dependent structure and dynamics of isopropanol–water liquid mixtures at low alcohol content S Pothoczki, L Pusztai, I Bakó The Journal of Physical Chemistry B 123 (35), 7599-7610, 2019 | 27 | 2019 |
Intermolecular orientations in liquid acetonitrile: new insights based on diffraction measurements and all-atom simulations S Pothoczki, L Pusztai Journal of Molecular Liquids 225, 160-166, 2017 | 25 | 2017 |
Interplay between intramolecular and intermolecular structures of 1, 1, 2, 2-tetrachloro-1, 2-difluoroethane M Rovira-Esteva, NA Murugan, LC Pardo, S Busch, JL Tamarit, ... Physical Review B—Condensed Matter and Materials Physics 84 (6), 064202, 2011 | 25 | 2011 |
An approach towards understanding the structure of complex molecular systems: the case of lower aliphatic alcohols A Vrhovšek, O Gereben, S Pothoczki, M Tomšič, A Jamnik, S Kohara, ... Journal of Physics: Condensed Matter 22 (40), 404214, 2010 | 25 | 2010 |
Temperature dependent dynamics in water-ethanol liquid mixtures S Pothoczki, L Pusztai, I Bakó Journal of Molecular Liquids 271, 571-579, 2018 | 24 | 2018 |
Structure of neat liquids consisting of (perfect and nearly) tetrahedral molecules S Pothoczki, L Temleitner, L Pusztai Chemical Reviews 115 (24), 13308-13361, 2015 | 22 | 2015 |
Extended orientational correlation study for molecular liquids containing distorted tetrahedral molecules: Application to methylene halides S Pothoczki, L Temleitner, L Pusztai The Journal of chemical physics 132 (16), 2010 | 22 | 2010 |
Role of steric and electrostatic effects in the short-range order of quasitetrahedral molecular liquids S Pothoczki, A Ottochian, M Rovira-Esteva, LC Pardo, JL Tamarit, ... Physical Review B—Condensed Matter and Materials Physics 85 (1), 014202, 2012 | 21 | 2012 |
Properties of hydrogen-bonded networks in ethanol–water liquid mixtures as a function of temperature: Diffraction experiments and computer simulations S Pothoczki, I Pethes, L Pusztai, L Temleitner, K Ohara, I Bakó The Journal of Physical Chemistry B 125 (23), 6272-6279, 2021 | 19 | 2021 |
Hydrogen bonding and percolation in propan-2-ol–Water liquid mixtures: X-ray diffraction experiments and computer simulations S Pothoczki, I Pethes, L Pusztai, L Temleitner, D Csókás, S Kohara, ... Journal of Molecular Liquids 329, 115592, 2021 | 17 | 2021 |
Detailed intermolecular structure of molecular liquids containing slightly distorted tetrahedral molecules with C3v symmetry: Chloroform, bromoform, and methyl-iodide S Pothoczki, L Temleitner, L Pusztai The Journal of Chemical Physics 134 (4), 2011 | 17 | 2011 |
Orientational correlations in molecular liquid SnI4 L Pusztai, S Pothoczki, S Kohara The Journal of chemical physics 129 (6), 2008 | 17 | 2008 |
Molecular liquid TiCl4 and VCl4: Two substances, one structure? S Pothoczki, L Pusztai Journal of Molecular Liquids 145 (1), 38-40, 2009 | 14 | 2009 |
The liquid structure of haloforms CHCl3 and CHBr3 S Pothoczki, L Temleitner, S Kohara, P Jóvári, L Pusztai Journal of Physics: Condensed Matter 22 (40), 404211, 2010 | 13 | 2010 |
Effects of H-bond asymmetry on the electronic properties of liquid water–An AIMD analysis I Bako, J Daru, S Pothoczki, L Pusztai, K Hermansson Journal of Molecular Liquids 293, 111579, 2019 | 11 | 2019 |
Competing structures within the first shell of liquid C2Cl6: a molecular dynamics study A Henao, S Pothoczki, M Canales, E Guardia, LC Pardo Journal of Molecular Liquids 190, 121-125, 2014 | 10 | 2014 |
Temperature dependent network stability in simple alcohols and pure water: The evolution of Laplace spectra I Bakó, I Pethes, S Pothoczki, L Pusztai Journal of Molecular Liquids 273, 670-675, 2019 | 9 | 2019 |
Comparison of the atomic level structure of the plastic crystalline and liquid phases of CBr2Cl2: neutron diffraction and reverse Monte Carlo modelling S Pothoczki, L Temleitner, LC Pardo, GJ Cuello, M Rovira-Esteva, ... Journal of physics: condensed matter 25 (45), 454216, 2013 | 8 | 2013 |