| Molecular dynamics calculation of the equation of state of alkanes S Toxvaerd The Journal of chemical physics 93 (6), 4290-4295, 1990 | 341 | 1990 |
| Communication: Shifted forces in molecular dynamics S Toxvaerd, JC Dyre The Journal of Chemical Physics 134 (8), 2011 | 223 | 2011 |
| The structure and thermodynamics of a solid–fluid interface S Toxvaerd The Journal of Chemical Physics 74 (3), 1998-2005, 1981 | 192 | 1981 |
| Contact angles of Lennard-Jones liquids and droplets on planar surfaces T Ingebrigtsen, S Toxvaerd The Journal of Physical Chemistry C 111 (24), 8518-8523, 2007 | 188 | 2007 |
| Perturbation theory for nonuniform fluids: Surface tension S Toxvaerd The Journal of chemical physics 55 (7), 3116-3120, 1971 | 175 | 1971 |
| Equation of state of alkanes II S Toxvaerd The Journal of chemical physics 107 (13), 5197-5204, 1997 | 168 | 1997 |
| Algorithms for canonical molecular dynamics simulations S Toxvaerd Molecular Physics 72 (1), 159-168, 1991 | 165 | 1991 |
| Self‐diffusion in n‐alkane fluid models P Padilla, S Toxvaerd The Journal of chemical physics 94 (8), 5650-5654, 1991 | 152 | 1991 |
| Molecular-dynamics simulation of homogeneous nucleation in the vapor phase S Toxvaerd The Journal of Chemical Physics 115 (19), 8913-8920, 2001 | 134 | 2001 |
| Phase transitions in a two-dimensional system S Toxvaerd Physical Review Letters 44 (15), 1002, 1980 | 128 | 1980 |
| Molecular dynamics simulations of Langmuir monolayers: A study of structure and thermodynamics S Karaborni, S Toxvaerd The Journal of chemical physics 96 (7), 5505-5515, 1992 | 118 | 1992 |
| Computer simulation of phase separation in a two-dimensional binary fluid mixture E Velasco, S Toxvaerd Physical review letters 71 (3), 388, 1993 | 116 | 1993 |
| Hidden scale invariance in molecular van der Waals liquids: A simulation study TB Schrøder, UR Pedersen, NP Bailey, S Toxvaerd, JC Dyre Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 80 (4 …, 2009 | 113 | 2009 |
| Molecular dynamics simulation of spinodal decomposition in three-dimensional binary fluids M Laradji, S Toxvaerd, OG Mouritsen Physical review letters 77 (11), 2253, 1996 | 113 | 1996 |
| Molecular dynamics at constant temperature and pressure S Toxvaerd Physical Review E 47 (1), 343, 1993 | 108 | 1993 |
| Dynamics of proteins in different solvent systems: analysis of essential motion in lipases GH Peters, DM Van Aalten, O Edholm, S Toxvaerd, R Bywater Biophysical journal 71 (5), 2245-2255, 1996 | 95 | 1996 |
| Molecular dynamics calculation of the liquid structure up to a solid surface S Toxvaerd, E Praestgaard The Journal of Chemical Physics 67 (11), 5291-5295, 1977 | 95 | 1977 |
| Statistical mechanical and quasithermodynamic calculations of surface densities and surface tension S Toxvaerd Molecular Physics 26 (1), 91-99, 1973 | 92 | 1973 |
| Molecular dynamics simulations of phase separation in the presence of surfactants M Laradji, OG Mouritsen, S Toxvaerd, MJ Zuckermann Physical Review E 50 (2), 1243, 1994 | 91 | 1994 |
| Stability of supercooled binary liquid mixtures S Toxvaerd, UR Pedersen, TB Schrøder, JC Dyre The Journal of chemical physics 130 (22), 2009 | 90 | 2009 |
