نتایج جستجو برای: molecular dynamics dimulation

تعداد نتایج: 1015731  

2010
R. Srivastava K. N. Khanna

The thermal conductivity of a system consisting of square-well particles has been determined by the extension of the Enskog formula of the hard-sphere model to square-well fluid. The approach is the same as applied for the diffusion coefficients and shear viscosity of square-well fluid. The addition of an attractive part in the hard-sphere potential such as square-well potential remains insensi...

2012
Michael Spanner Jochen Mikosch Andrey E. Boguslavskiy Margaret M. Murnane Albert Stolow Serguei Patchkovskii

Michael Spanner,1 Jochen Mikosch,1 Andrey E. Boguslavskiy,1 Margaret M. Murnane,2 Albert Stolow,1 and Serguei Patchkovskii1 1Steacie Institute for Molecular Sciences, National Research Council of Canada, Ottawa, Ontario, Canada K1A 0R6 2JILA and Department of Physics, University of Colorado and National Institute of Standards and Technology, Boulder, Colorado 80309-0440, USA (Received 2 Septemb...

2005
Akira Ono

The antisymmetrized molecular dynamics (AMD) simulations suggest that the isospin composition of fragments produced dynamically in multifragmentation reactions is basically governed by the symmetry energy of low-density uniform nuclear matter rather than the symmetry energy for the ground-state finite nuclei. After the statistical secondary decay of the excited fragments, the symmetry energy ef...

2007
Chuang Deng

Parallel molecular dynamics simulations were used to study the influence of pre-existing growth twin boundaries on the slip activity of bulk gold under uniaxial compression. The simulations were performed on a 3D, fully periodic simulation box at 300 K with a constant strain rate of 4×10 s. Different twin boundary interspacings from 2 nm to 16 nm were investigated. The strength of bulk nano-twi...

1995
Patricio Cordero

The phenomenon of heat conduction in a two-dimensional gas of N hard disks is studied in the hydrostatic regime by means of nonequilibrium molecular dynamics (N ranging from 100 to 8000). For systems with N>~I500 the temperature and density profiles observed are in excellent agreement with the continuous theory, but the conductivity k differs from the one derived from Enskog's theory in a syste...

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