Computer Modeling of Matter PDF
278 Pages·1978·4.24 MB·English
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Content: Molecular dynamics simulations of liquids with ionic interactions / K. Heinzinger, W.O. Riede, L. Schaefer, and Gy. I. Szász -- Monte Carlo simulation of water / C.S. Pangali, M. Rao, and B.J. Berne -- Determination of the mean force of two noble gas atoms dissolved in water / C.S. Pangali, M. Rao, and B.J. Berne -- Applying the polarization model to the hydrated lithium cation / Carl W. David -- Molecular dynamics simulation of methane using a singularity-free algorithm / S. Murad and K.E. Gubbins -- Structure of a liquid-vapor interface / M. Rao and B.J. Berne -- Computer simulation of the liquid-vapor surface of molecular fluids / S.M. Thompson and K.E. Gubbins -- High field conductivity / Benson R. Sundheim -- Computer simulation of collective modes in solids / M.L. Klein -- Computer simulations of the melting and freezing of simple systems using an array processor / G. Chester, R. Gann, R. Gallagher, and A. Grimison -- Simulating the dynamic and equilibrium properties of a multichain polymer system / David E. Kranbuehl and Bruce Schardt -- Application of conformational energy calculations to defect properties in polymer crystals / Richard H. Boyd -- Multiple time step methods and an improved potential function for molecular dynamics simulations of molecular liquids / W.B. Streett, D.J. Tildesley, and G. Saville -- Optimization of sampling algorithms in Monte Carlo calculations on fluids / John C. Owicki -- Molecular dynamics simulations of simple fluids with three-body interactions included / J.M. Haile -- Monte Carlo studies of the structure of liquid water and dilute aqueous solutions / David L. Beveridge, Mihaly Mezei, S. Swaminathan, and S.W. Harrison -- Computer modeling of quantum liquids and crystals / M.H. Kalos, P.A. Whitlock, and D.M. Ceperley -- From microphysics to macrochemistry via discrete simulations / Jack S. Turner.
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