Computational statistical mechanics methodology, applications and supercomputing

Equation of State Calculations by Fast Computing Machines

1953 • 34,935 citations

An introduction to probability theory and its applications

1958 • 31,109 citations

The Fractal Geometry of Nature

1983 • 22,064 citations

Canonical dynamics: Equilibrium phase-space distributions

1985 • 20,411 citations

Polymorphic transitions in single crystals: A new molecular dynamics method

1981 • 16,818 citations

A unified formulation of the constant temperature molecular dynamics methods

1984 • 16,207 citations

Quantum Mechanics and Path Integrals

1966 • 10,030 citations

Stochastic Processes in Physics and Chemistry

2007 • 9,372 citations

A molecular dynamics method for simulations in the canonical ensemble

1984 • 9,063 citations

Ordering, metastability and phase transitions in two-dimensional systems

1973 • 8,845 citations

Computer "Experiments" on Classical Fluids. I. Thermodynamical Properties of Lennard-Jones Molecules

1967 • 8,657 citations

Theory of simple liquids

1976 • 8,042 citations

The kinetics of precipitation from supersaturated solid solutions

1961 • 7,826 citations

Theory of elasticity

1951 • 6,065 citations

The Fractal Geometry of Nature

1982 • 5,450 citations

Molecular dynamics simulations at constant pressure and/or temperature

1980 • 5,396 citations

Diffusion-Limited Aggregation, a Kinetic Critical Phenomenon

1981 • 5,231 citations

Computer simulation of local order in condensed phases of silicon

1985 • 5,015 citations

Irreversibility and Heat Generation in the Computing Process

1961 • 4,265 citations

Applied Numerical Methods

1970 • 3,583 citations

Crystal Structure and Pair Potentials: A Molecular-Dynamics Study

1980 • 3,266 citations

Lattice-Gas Automata for the Navier-Stokes Equation

1986 • 2,689 citations

Correlations in the Motion of Atoms in Liquid Argon

1964 • 2,482 citations

Phase Transition for a Hard Sphere System

1957 • 2,419 citations

Synergetics, Introduction to

2009 • 2,418 citations

Effect of Invariance Requirements on the Elastic Strain Energy of Crystals with Application to the Diamond Structure

1966 • 2,355 citations

Studies in Molecular Dynamics. I. General Method

1959 • 2,318 citations

Thermodynamics and an Introduction to Thermostatistics

1987 • 2,317 citations

Dislocation-mediated melting in two dimensions

1979 • 2,263 citations

Computer Simulation Using Particles

1981 • 2,204 citations

Theory of crystal dislocations

1967 • 2,061 citations

What is "liquid"? Understanding the states of matter

1976 • 2,050 citations

Stochastic Processes in Physics and Chemistry

2005 • 2,029 citations

Theory of Two-Dimensional Melting

1978 • 1,835 citations

The thermodynamics of computation—a review

1982 • 1,814 citations

The physical interaction of gases with crystalline solids

1973 • 1,574 citations

Commensurate phases, incommensurate phases and the devil's staircase

1982 • 1,474 citations

One-dimensional dislocations. I. Static theory

1949 • 1,473 citations

An Introduction to Probability Theory and its Applications.

1951 • 1,422 citations

Melting and the vector Coulomb gas in two dimensions

1979 • 1,421 citations

Treatise on Solid State Chemistry

1976 • 1,412 citations

Molecular Dynamics Study of Liquid Water

1971 • 1,365 citations

Materials Research Society Symposium Proceedings

2007 • 1,347 citations

New empirical model for the structural properties of silicon

1986 • 1,345 citations

Two-Dimensional Interfacial Colloidal Crystals

1980 • 1,328 citations

Monte Carlo Methods in Statistical Physics

1979 • 1,230 citations

Dynamics of Radiation Damage

1960 • 1,225 citations

Physics of simple liquids

1968 • 1,200 citations

Molecular Hydrodynamics

2003 • 1,058 citations

Evidence for a Liquid-to-Crystal Phase Transition in a Classical, Two-Dimensional Sheet of Electrons

1979 • 1,018 citations

Monte Carlo Methods in Statistical Physics

1986 • 993 citations

Long range order and metastability in two dimensional solids and superfluids. (Application of dislocation theory)

1972 • 874 citations

Mathematical Theory of Connecting Networks and Telephone Traffic

1966 • 833 citations

Kinetics of Aggregation and Gelation

1984 • 822 citations

Fundamental Problems in Statistical Mechanics

1962 • 814 citations

Homogeneous Nucleation Theory

1974 • 792 citations

Computer simulation and the statistical mechanics of adsorption

1983 • 782 citations

Phase Transition in Elastic Disks

1962 • 753 citations

Applications of the Monte Carlo Method in Statistical Physics

1987 • 749 citations

Synergetics: An Introduction

2020 • 735 citations

PERTURBATION-THEORY WITHOUT GAUGE FIXING

1981 • 701 citations

Monte Carlo methods

1986 • 694 citations

Computer simulation and the statistical mechanics of adsorption

1982 • 663 citations

Non-Newtonian molecular dynamics

1984 • 640 citations

High-Strain-Rate Plastic Flow Studied via Nonequilibrium Molecular Dynamics

1982 • 611 citations

Rare gas solids

1976 • 593 citations

Ordering in Two Dimensions

1980 • 579 citations

Isothermal molecular dynamics calculations for liquid salts

1971 • 543 citations

Homogeneous Nucleation Theory

1974 • 528 citations

Collected papers of L. D. Landau

1966 • 524 citations

Applications of the Monte Carlo Method in Statistical Physics

1984 • 520 citations

Computer ‘‘experiment’’ for nonlinear thermodynamics of Couette flow

1983 • 485 citations

Monte Carlo simulations of one-dimensional fermion systems

1982 • 481 citations

Ordering in Strongly Fluctuating Condensed Matter Systems

1980 • 476 citations

Phase Transitions in Surface Films

1980 • 463 citations

Fluctuations and Irreversible Process. II. Systems with Kinetic Energy

1953 • 443 citations

Collected Papers of L.D. Landau

1965 • 427 citations

Statistical Mechanics

1985 • 403 citations

On numerical integration of ordinary differential equations

1962 • 393 citations

The Fundamental Physical Limits of Computation

1985 • 390 citations

Films on Solid Surfaces

1976 • 371 citations

Geometrical cluster growth models and kinetic gelation

1986 • 354 citations

The Molten state of matter

1978 • 338 citations

On growth and form : fractal and non-fractal patterns in physics

1986 • 325 citations

Introduction to the Theory of Metastable and Unstable States

1983 • 321 citations

Interatomic Potentials for Silicon Structural Energies

1985 • 320 citations

Nonequilibrium Molecular Dynamics

1983 • 303 citations

Substrate-induced strain and orientational ordering in adsorbed monolayers

1979 • 302 citations

Grain-boundary theory of melting in two dimensions

1983 • 285 citations

The Dynamics of Proteins

1986 • 281 citations

Two-dimensional phase transitions as displayed by adsorption isotherms on graphite and other lamellar solids

1981 • 279 citations

Dynamical scaling of structure function in quenched binary alloys

1982 • 266 citations

Computer Simulation of the Time Evolution of a Quenched Model Alloy in the Nucleation Region

1979 • 263 citations

Protein dynamics

1984 • 255 citations

Computer Studies of Phase Transitions and Critical Phenomena

1984 • 248 citations

Structural Transitions in Superionic Conductors

1983 • 248 citations

Dislocations and the commensurate-incommensurate transition in two dimensions

1982 • 244 citations

Dynamics of the formation of two-dimensional ordered structures

1984 • 240 citations

Undecidability and intractability in theoretical physics

1985 • 235 citations

Structural Phase Transition in Epitaxial Solid Krypton Monolayers on Graphite

1977 • 227 citations

Computer simulation of the dynamics of hydrated protein crystals and its comparison with x-ray data.

1983 • 223 citations

Commensurate-incommensurate transitions in rare-gas monolayers adsorbed on graphite and in layered charge-density-wave systems

1979 • 218 citations

Phase diagram of the two-dimensional Lennard-Jones system; Evidence for first-order transitions

1981 • 212 citations

On Growth and Form

1985 • 211 citations

The isothermal/isobaric molecular dynamics ensemble

1983 • 207 citations

Thermodynamic study of the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mmultiscripts><mml:mrow><mml:mi mathvariant="normal">He</mml:mi></mml:mrow><mml:mprescripts /><mml:mrow /><mml:mrow><mml:mn>4</mml:mn></mml:mrow><mml:mrow /><mml:mrow /></mml:mmultiscripts></mml:mrow></mml:math>monolayer adsorbed on Grafoil

1974 • 199 citations

Dislocations and the Commensurate-Incommensurate Transition in Two Dimensions

1981 • 199 citations

Atomistics of Fracture

1983 • 192 citations

PERSPECTIVES IN THE KINETICS OF AGGREGATION AND GELATION

1984 • 189 citations

Finite-size rounding of a first-order phase transition

1980 • 188 citations

Isothermal-isobaric molecular dynamics

1983 • 184 citations

Evidence for an Orientationally Ordered Two-Dimensional Fluid Phase from Molecular-Dynamics Calculations

1979 • 172 citations

High-resolution x-ray-scattering study of the commensurate-incommensurate transition of monolayer Kr on graphite

1984 • 168 citations

Identifying clusters in computer experiments on systems of particles

1978 • 164 citations

The Arrow of Time

1975 • 163 citations

The phases of two-dimensional matter, their transitions, and solid-state stability: A perspective via computer simulation of simple atomic systems

1981 • 162 citations

On the thermodynamics, structure and phase stability of the nonuniform fluid state

1979 • 159 citations

Progress in Theoretical Physics

1950 • 156 citations

The Nonregistered-Registered Phase Transition of Rare Gas Monolayers Adsorbed on Graphite. II

1980 • 154 citations

Monte Carlo Methods in Quantum Problems

1984 • 153 citations

Domain Walls and the Melting of Commensurate Surface Phases

1982 • 153 citations

Static properties of physisorbed monolayers in their solid phases

1983 • 144 citations

X-Ray Scattering Study of the Commensurate-Incommensurate Transition of Monolayer Krypton on Graphite

1979 • 140 citations

Computer Software in Science and Mathematics

1984 • 140 citations

Commensurate-incommensurate transition of solid krypton monolayers on graphite

1980 • 140 citations

The fcc (111) and (100) crystal–melt interfaces: A comparison by molecular dynamics simulation

1981 • 139 citations

Synchrotron X-Ray Study of the Commensurate-Incommensurate Transition of Monolayer Krypton on Graphite

1981 • 139 citations

Role of Relaxation in Epitaxial Growth: A Molecular-Dynamics Study

1985 • 138 citations

Melting in Two Dimensions is First Order: An Isothermal-Isobaric Monte Carlo Study

1980 • 137 citations

Surface free energy and stress of a Lennard-Jones crystal

1983 • 132 citations

Two-Dimensional Rare Gas Solids

1986 • 129 citations

Flows Far From Equilibrium Via Molecular Dynamics

1986 • 126 citations

A molecular dynamics simulation of nitrogen adsorbed on graphite

1984 • 119 citations

Analytic Form for the Static Structure Factor for a Finite Two-Dimensional Harmonic Lattice

1981 • 119 citations

Freezing Transition of Monolayer Xenon on Graphite

1982 • 117 citations

Commensurate-Incommensurate Phase Diagrams for Overlayers from a Helical Potts Model

1982 • 117 citations

X-ray scattering study of the structure and freezing transition of monolayer xenon on graphite

1983 • 117 citations

Computer Simulations of Freezing and Supercooled Liquids

1980 • 115 citations

Time Dependence of Flow Patterns near the Convective Threshold in a Cylindrical Container

1985 • 115 citations

Molecular-Dynamics Simulations of the Incommensurate Phase of Krypton on Graphite Using More than 100 000 Atoms

1984 • 112 citations

Pulsed melting of silicon (111) and (100) surfaces simulated by molecular dynamics

1986 • 112 citations

Heat Capacity of Krypton Physisorbed on Graphite

1979 • 110 citations

Structural Transformations in Solid Nitrogen at High Pressure

1983 • 110 citations

Bulk viscosity via nonequilibrium and equilibrium molecular dynamics

1980 • 109 citations

Synchrotron x-ray study of melting in submonolayer Ar and other rare-gas films on graphite

1982 • 106 citations

The Nonregistered-Registered Phase Transition of Rare Gas Monolayers Adsorbed on Graphite

1979 • 106 citations

Dynamics of phase separation in two-dimensional fluids: Spinodal decomposition

1983 • 104 citations

Lateral variation of the physisorption potential for noble gases on graphite

1984 • 104 citations

Phase Transitions in a Two-Dimensional System

1980 • 103 citations

Two-dimensional computer studies of crystal stability and fluid viscosity

1974 • 103 citations

Monte Carlo studies of two-dimensional melting: Dislocation vector systems

1982 • 101 citations

Theory of Heat

1967 • 99 citations

Theory of Heat

1967 • 99 citations

Monte Carlo study of melting in two dimensions

1982 • 98 citations

A Monte Carlo study of the two-dimensional Lennard-Jones system

1974 • 95 citations

Mathematical Theory of Connecting Networks and Telephone Traffic

1965 • 95 citations

Phase Transitions in Monomolecular Layer Films Physisorbed on Crystalline Surfaces

1980 • 92 citations

Convection Patterns: Time Evolution of the Wave-Vector Field

1985 • 87 citations

Pressure-Driven Commensurate-Incommensurate Transition in Low-Temperature Submonolayer Krypton on Graphite

1981 • 86 citations

Studies of the Orientational Ordering Transition in Nitrogen Adsorbed on Graphite

1983 • 84 citations

Krypton on graphite: Microstructure at zero temperature

1983 • 82 citations

Orientational order in xenon fluid monolayers on single crystals of exfoliated graphite

1985 • 82 citations

Dynamical Scaling in the Glass System<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">B</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>-PbO-<mml:…

1981 • 82 citations

Observation of finite-temperature bain transformation (f.c.c. →r b.c.c.) in Monte Carlo simulation of iron

1983 • 80 citations

Melting in two dimensions: Determination of phase transition boundaries

1980 • 80 citations

Experimental Observation of Continuous Melting into a Hexatic Phase

1983 • 78 citations

Melting of Two-Dimensional Solids

1982 • 76 citations

Orientational Order at the Two-Dimensional Melting Transition

1984 • 74 citations

Computer-Simulation Dynamics of an Unstable Two-Dimensional Fluid: Time-Dependent Morphology and Scaling

1982 • 68 citations

Computer simulations of surfaces, interfaces, and physisorbed films

1984 • 68 citations

Constant pressure molecular dynamics simulations of the 2D r−12 system: Comparison with isochores and isotherms

1981 • 68 citations

Monte Carlo calculations for solid CO and N₂overlayers physisorbed on graphite

1985 • 68 citations

Entropy for Small Classical Crystals

1968 • 65 citations

A general kinetic theory of liquids. IV. Quantum mechanics of fluids

1947 • 64 citations

The adsorption of carbon monoxide on graphite

1984 • 64 citations

Melting in a two-dimensional Lennard-Jones system

1978 • 64 citations

Melting transition of submonolayer xenon, krypton, and argon films on graphite: A computer simulation study

1983 • 64 citations

Melting Transition of Near-Monolayer Xenon Films on Graphite: A Computer Simulation Study

1983 • 63 citations

Freezing transition of xenon on graphite: A computer-simulation study

1983 • 62 citations

Molecular-Dynamics Computer Simulation of the Weakly Incommensurate Phase of Monolayer Krypton on Graphite

1982 • 61 citations

Numerical Fluid Dynamics

1983 • 60 citations

Neutron Scattering Studies of Physisorbed Monolayers on Graphite

1980 • 58 citations

New High-Pressure Phase of Solid<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mmultiscripts><mml:mrow><mml:mi mathvariant="normal">He</mml:mi></mml:mrow><mml:mprescripts /><mml:mrow /><mml:mrow><mml:mn>4</mml:mn></mml:mrow><mml:mrow /><mml:mrow /></mml:mmultiscripts></mml:mrow></mml:math>Is bcc

1983 • 54 citations

A grand ensemble Monte Carlo study of krypton adsorbed on graphite

1983 • 52 citations

Structure of liquid and solid monolayer xenon on graphite

1980 • 52 citations

Molecular-dynamics investigation of solid–liquid coexistence

1978 • 51 citations

Effects of energy heterogeneity on phase transitions in a model monolayer system

1982 • 50 citations

Two-dimensional melting, solid-state stability, and the Kosterlitz-Thouless-Feynman criterion

1981 • 48 citations

Two-Dimensional Solids and Their Interaction with Substrates

1980 • 47 citations

A molecular dynamics study of the melting of a two-dimensional crystal

1972 • 46 citations

Dislocation Energies in Rare-Gas Monolayers on Graphite

1985 • 45 citations

Non-cylindrical growth habit of float zoned dislocation-free [111] silicon crystals

1971 • 43 citations

Melting transition of near-monolayer xenon films on graphite: A computer simulation study. II.

1984 • 42 citations

Simulation of Tunneling States in Random-Network Glasses

1979 • 39 citations

Advances in Chemical Physics

1986 • 39 citations

Models of impurity trapping during rapid solidification

1984 • 38 citations

A. R. Ubbelohde: The Molten State of Matter, John Wiley & Sons, Chichester and New York, 1978, xiv+454ページ, 23.5×16cm, 15,910円.

1980 • 34 citations

An Approach to Complexity: Numerical Computations

1985 • 34 citations

Perspectives on Supercomputing

1985 • 32 citations

Molecular dynamics simulation of submonolayer krypton films on graphite

1980 • 29 citations

Engineering limits on computer performance

1984 • 28 citations

Fundamental Physical Limitations of the Computational Process

1984 • 28 citations

The freezing transition of monolayer xenon on single crystal graphite

1985 • 28 citations

Predictions for the pressure and temperature phase transitions of silicon using a semiempirical potential

1985 • 27 citations

Relaxation and fluctuation effects near the melting transition in a two-dimensional solid

1982 • 27 citations

Phase Separation in Fluid Systems by Spinodal Decomposition: A Molecular-Dynamics Simulation

1976 • 26 citations

Energetics of the incommensurate phase of krypton on graphite: A computer simulation study

1985 • 26 citations

Langevin dynamics simulations of phase separation in a one-component system

1986 • 25 citations

Evidence against a crystal instability in melting

1980 • 25 citations

The commensurate-incommensurate transition of krypton on graphite: A study via computer simulation

1984 • 25 citations

Design and Implementation of the Delft Molecular-Dynamics Processor

1988 • 23 citations

Computer simulation of many-body dynamics

1984 • 23 citations

Static Structure Factor for a Finite Incommensurate Monolayer

1981 • 22 citations

New results on the quenched "1×1" structure of Si{111} surfaces

1983 • 21 citations

Parallel architectures for computer systems

1984 • 20 citations

Structure of axially compressed monolayers of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">N</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>physisorbed on graphite

1985 • 20 citations

Superpolymers, ultraweak solids and aggregates

1984 • 20 citations

Computers in physics: an overview

1983 • 20 citations

Impact of computers on aerodynamics research and development

1984 • 19 citations

Soliton theory for the weakly incommensurate phase of monolayer krypton or graphite

1983 • 18 citations

Characterization of the surface net and electronic structure of AuGa2(001)

1984 • 18 citations

Scaling and mean-field-like behaviour in phase separation processes

1985 • 16 citations

Molecular dynamics studies of argon-diluted nitrogen films adsorbed on graphite

1985 • 16 citations

The Dynamics of Phase Separation Near the Critical Point: Spinodal Decomposition and Nucleation

1981 • 14 citations

Hurlbut and Dash Respond

1985 • 12 citations

Quantum mechanical simulation of liquids

1985 • 10 citations

Condensed-matter physics

1983 • 10 citations

Constrained dynamics and its application to the isothermal-isobaric simulation of the supercooled-liquid/glass transition region

1986 • 9 citations

Comment on "Two-Dimensional Pressure of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mmultiscripts><mml:mrow><mml:mi mathvariant="normal">He</mml:mi></mml:mrow><mml:mprescripts /><mml:mrow /><mml:mrow><mml:mn>4</mml:mn></mml:mrow><mml:mrow /><mml:mrow /></mml:mmultiscripts></mml:mrow></mml:math>Monolayers: First-Order Melting of the Incommensurate Solid"

1985 • 8 citations

The Dislocation Theory of Melting: History, Status, and Prognosis

1980 • 7 citations

Computations in plasma physics

1983 • 6 citations

High‐energy physics

1983 • 5 citations

Thermodynamics of monolayer formation on an impure substrate: Random-field Ising-model approach

1985 • 4 citations

Hydrodynamic fluctuation theory of spinodal decomposition: The linear regime

1982 • 4 citations

The centennial year

1984 • 2 citations

A UNIFIED THEORY OF MELTING CRYSTALLIZATION AND GLASS FORMATION

1975 • 2 citations