Dipole moment fluctuation formulas in computer simulations of polar systems

Theory of Electric Polarization

1974 • 3,387 citations

Theory of dielectrics

1949 • 2,245 citations

The Dielectric Polarization of Polar Liquids

1939 • 1,812 citations

Molecular Dynamics Study of Liquid Water

1971 • 1,365 citations

Simulation of electrostatic systems in periodic boundary conditions. I. Lattice sums and dielectric constants

1980 • 1,309 citations

Monte Carlo studies of the dielectric properties of water-like models

1973 • 690 citations

Thermodynamic and structural properties of liquids modelled by ‘2-Lennard-Jones centres’ pair potentials

1977 • 355 citations

The computer simulation of polar liquids

1979 • 254 citations

Image approximation to the reaction field

1975 • 236 citations

Simulation of electrostatic systems in periodic boundary conditions. II. Equivalence of boundary conditions

1980 • 227 citations

Reaction field simulation of water

1982 • 197 citations

Monte Carlo studies of liquid water

1974 • 170 citations

An integral equation theory for the dense dipolar hard-sphere fluid

1977 • 160 citations

The influence of boundary conditions used in machine simulations on the structure of polar systems

1980 • 149 citations

On the calculation of the dielectric constant using the Ewald-Kornfeld tensor

1983 • 144 citations

Static dielectric properties of Stockmayer fluids

1980 • 143 citations

Thermodynamic and dielectric properties of polar lattices

1976 • 132 citations

On the theory and computer simulation of dipolar fluids

1982 • 128 citations

A Monte Carlo study of dipolar hard spheres The pair distribution function and the dielectric constant

1977 • 113 citations

Static dielectric properties of the Stockmayer fluid from computer simulation

1981 • 100 citations

Fluids of spheres containing quadrupoles and dipoles: A study using perturbation theory and Monte Carlo computations

1976 • 97 citations

Integral equation approximations for dipolar fluids

1979 • 95 citations

Monte-Carlo simulation of water

1977 • 88 citations

Dipolar hard spheres: A Monte Carlo study

1974 • 86 citations

Long-range dipolar interactions in computer simulations of polar liquids

1978 • 67 citations

Computer simulation of highly polar liquids: The hard sphere plus point dipole potential

1980 • 64 citations

Theoretical determination of the dielectric constant of a two dimensional dipolar fluid

1981 • 61 citations

Integral equation approximations for fluids of hard spheres with dipoles and quadrupoles

1979 • 56 citations

Fluctuation theorems for dielectrics with periodic boundary conditions

1980 • 55 citations

Molecular dynamics calculation of the dielectric constant

1980 • 43 citations

Molecular dynamics calculation of the dielectric constant

1980 • 39 citations

Electric polarisation of water: Monte Carlo studies

1981 • 38 citations

Molecular dynamics calculation of the dielectric constant without periodic boundary conditions. I

1979 • 37 citations

On the Orientational Structure and Dielectric Properties of Water. A Comparison of ST2 and MCY Potential

1983 • 25 citations

Molecular dynamics calculation of the dielectric constant

1981 • 18 citations

Simulation of two dimensional systems with two dimensional electrostatics

1982 • 18 citations

Computer simulation of polar liquids the influence of molecular shape

1982 • 15 citations

Fluctuation theorems for dielectrics

1979 • 15 citations