| An improved potential for non-rigid water molecules in the liquid phase P Bopp, G Jancsó, K Heinzinger Chemical Physics Letters 98 (2), 129-133, 1983 | 559 | 1983 |
| Molecular dynamics and x-ray investigation of an aqueous calcium chloride solution MM Probst, T Radnai, K Heinzinger, P Bopp, BM Rode The Journal of Physical Chemistry 89 (5), 753-759, 1985 | 210 | 1985 |
| Static nonlocal dielectric function of liquid water PA Bopp, AA Kornyshev, G Sutmann Physical review letters 76 (8), 1280, 1996 | 193 | 1996 |
| Molecular dynamics simulation study of an n-decyltrimethylammonium chloride micelle in water J Boecker, J Brickmann, P Bopp The Journal of Physical Chemistry 98 (2), 712-717, 1994 | 150 | 1994 |
| Enantioselective recognition at mesoporous chiral metal surfaces C Wattanakit, YB Saint Côme, V Lapeyre, PA Bopp, M Heim, S Yadnum, ... Nature communications 5 (1), 1-8, 2014 | 144 | 2014 |
| Molecular dynamics simulation of zeolite NaY: a study of structure, dynamics, and thermalization of sorbates G Schrimpf, M Schlenkrich, J Brickmann, P Bopp The Journal of Physical Chemistry 96 (18), 7404-7410, 1992 | 142 | 1992 |
| Molecular dynamics study of high-density liquid water using a modified central-force potential G Jancsǒ, P Bopp, K Heinzinger Chemical physics 85 (3), 377-387, 1984 | 140 | 1984 |
| Frequency and wave-vector dependent dielectric function of water: Collective modes and relaxation spectra PA Bopp, AA Kornyshev, G Sutmann The Journal of chemical physics 109 (5), 1939-1958, 1998 | 136 | 1998 |
| Molecular dynamics simulation of a n-hexadecyltrimethylammonium chloride monolayer J Boecker, M Schlenkrich, P Bopp, J Brickmann The Journal of Physical Chemistry 96 (24), 9915-9922, 1992 | 134 | 1992 |
| A study of the vibrational motions of water in an aqueous CaCl2 solution P Bopp Chemical physics 106 (2), 205-212, 1986 | 133 | 1986 |
| A Molecular Dynamics Study of Aqueous Solutions: X. First Results for a NaCl Solution with a Central Force Model for Water P Bopp, W Dietz, K Heinzinger Zeitschrift für Naturforschung A 34 (12), 1424-1435, 1979 | 86 | 1979 |
| Theoretical investigations on 1, 2‐ethanediol: The problem of intramolecular hydrogen bonds S Reiling, J Brickmann, M Schlenkrich, PA Bopp Journal of computational chemistry 17 (2), 133-147, 1996 | 72 | 1996 |
| Molecular dynamics study of the effect of pressure on an aqueous NaCl solution G Jancso, K Heinzinger, P Bopp Zeitschrift für Naturforschung A 40 (12), 1235-1247, 1985 | 70 | 1985 |
| The vibration of atoms at high miller index surfaces: face centred cubic metals JE Black, P Bopp Surface Science 140 (2), 275-293, 1984 | 70 | 1984 |
| Structure and dynamics of water confined in single-wall nanotubes T Nanok, N Artrith, P Pantu, PA Bopp, J Limtrakul The Journal of Physical Chemistry A 113 (10), 2103-2108, 2009 | 63 | 2009 |
| Influence on isotope effect calculations of the method of obtaining force constants from vibrational data DZ Goodson, SK Sarpal, P Bopp, M Wolfsberg The Journal of Physical Chemistry 86 (5), 659-663, 1982 | 59 | 1982 |
| Combining extended x-ray absorption fine structure with numerical simulations for disordered systems G Ferlat, JC Soetens, A San Miguel, PA Bopp Journal of Physics: Condensed Matter 17 (5), S145, 2005 | 53 | 2005 |
| Comparison of the structure of liquid amides as determined by diffraction experiments and molecular dynamics simulations PC Schoester, MD Zeidler, T Radnai, PA Bopp Zeitschrift für Naturforschung A 50 (1), 38-50, 1995 | 51 | 1995 |
| Molecular dynamics computer simulations of solvation in hydrogen bonded systems P Bopp Pure and Applied Chemistry 59 (9), 1071-1082, 1987 | 51 | 1987 |
| Theoretical Studies on the Pyridine−I2 Charge-Transfer Complex. 1. Ab-Initio Calculations on I2 and Pyridine−I2 S Reiling, M Besnard, PA Bopp The Journal of Physical Chemistry A 101 (24), 4409-4415, 1997 | 48 | 1997 |
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