A j-walking algorithm for microcanonical simulations: Applications to Lennard-Jones clusters

Handbook of Mathematical Functions

1966 • 42,275 citations

Equation of State Calculations by Fast Computing Machines

1953 • 34,935 citations

Hidden structure in liquids

1982 • 1,328 citations

Monte Carlo methods

1986 • 694 citations

Statistical thermodynamics of the cluster solid-liquid transition

1990 • 479 citations

Ensemble Dependence of Fluctuations with Application to Machine Computations

1967 • 475 citations

Reducing quasi-ergodic behavior in Monte Carlo simulations by J-walking: Applications to atomic clusters

1990 • 301 citations

Laplace-transform technique for deriving thermodynamic equations from the classical microcanonical ensemble

1985 • 194 citations

Use of the histogram and jump-walking methods for overcoming slow barrier crossing behavior in Monte Carlo simulations: Applications to the phase transitions in the (Ar)13 and (H2O)8 clusters

1993 • 146 citations

An efficient microcanonical sampling procedure for molecular systems

1991 • 135 citations

Efficient microcanonical sampling for a preselected total angular momentum

1990 • 96 citations

Extending J walking to quantum systems: Applications to atomic clusters

1992 • 76 citations

Magic numbers for classical Lennard-Jones cluster heat capacities

1995 • 72 citations

COMPUTATIONAL STUDIES OF CLUSTERS:Methods and Results

1996 • 70 citations

A semi-empirical potential for simulations of transition metal clusters: Minima and isomers of Nin (n=2–13) and their hydrides

1998 • 67 citations

Isomerization dynamics and ergodicity in Ar7

1997 • 41 citations

Computational study of the structures and thermodynamic properties of ammonium chloride clusters using a parallel jump-walking approach

1996 • 38 citations

Structure, dynamics, and thermodynamics of benzene-Arn clusters (1⩽n⩽8 and n=19)

1997 • 27 citations

A microcanonical Monte Carlo method for simulating vibrationally excited molecules embedded in clusters

1997 • 5 citations