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Molecular-Simulation-Code

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  • Update : 2014-08-30
  • Size : 1.95mb
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  • Author :Li Kejiang
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Molecular Simulation From Algorithms to Applications (官方代码)
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分子动力学模拟官方代码
......................\CaseStudy_1-Equation of State of the Lennard-Jones Fluid (NVT).zip
......................\CaseStudy_10-Lennard-Jones Andersen thermostat.zip
......................\CaseStudy_11-Lennard-Jones Nose-Hoover thermostat.zip
......................\CaseStudy_12-Harmonic Oscillator (I).zip
......................\CaseStudy_13-Harmonic Oscillator (II).zip
......................\CaseStudy_14-Chemical Potential Widom Method.zip
......................\CaseStudy_15-Chemical Potential Overlapping Distribution.zip
......................\CaseStudy_16-Phase Equilibria of the Lennard-Jones Fluid.zip
......................\CaseStudy_17-Solid-Liquid Equilibrium of Hard Spheres.zip
......................\CaseStudy_18-Equation of State of Lennard-Jones Chains.zip
......................\CaseStudy_19-Generation of Trial Configurations of Ideal Chains.zip
......................\CaseStudy_20-Recoil Growth Simulation of Lennard-Jones Chains.zip
......................\CaseStudy_21-Parallel Tempering of a Single Particle.zip
......................\CaseStudy_22-Multiple Time Step versus Constraints.zip
......................\CaseStudy_23-Ideal Gas Particle over a Barrier.zip
......................\CaseStudy_24-Ideal Gas Particle in a Two-dimensional Potential.zip
......................\CaseStudy_25-Dissipative Particle Dynamics.zip
......................\CaseStudy_26-Comparison of Schemes for the LJ Fluid .zip
......................\CaseStudy_4-Static Properties of the Lennard-Jones Fluid.zip
......................\CaseStudy_5-Dynamic Properties of the Lennard-Jones Fluid.zip
......................\CaseStudy_6-Algorithms to Calculate the Mean Square Displacement.zip
......................\CaseStudy_7-Equation of State of the Lennard-Jones Fluid.zip
......................\CaseStudy_8-Phase Equilibria from Constant Pressure Simulations.zip
......................\CaseStudy_9-Equation of State of the Lennard-Jones Fluid.zip
......................\Exercise_1-Distribution of Particles.zip
......................\Exercise_10-Molecular Dynamics of a Lennard-Jones System.zip
......................\Exercise_11-Monte Carlo in the NPT Ensemble.zip
......................\Exercise_12-Ising Model.zip
......................\Exercise_13-Barrier Crossing.zip
......................\Exercise_14a-Vapor-Liquid Equilibrium.zip
......................\Exercise_14b-Vapor-Liquid Equilibrium.zip
......................\Exercise_15-CBMC of a Single Chain.zip
......................\Exercise_16-CBMC of a Simple System .zip
......................\Exercise_2-Boltzmann Distribution.zip
......................\Exercise_3-Coupled Harmonic Oscillators.zip
......................\Exercise_4-Random Walk on a 1D Lattice.zip
......................\Exercise_5-Random Walk on a 2D Lattice.zip
......................\Exercise_6-Calculation of Pi.zip
......................\Exercise_7-The Photon Gas.zip
......................\Exercise_8-Monte Carlo Simulation of a Lennard-Jones System.zip
......................\Exercise_9-Scaling as a Monte Carlo Move.zip
......................\lib.zip
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