Maximally Discretized Molecular Dynamics
- 25 July 1988
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review Letters
- Vol. 61 (4) , 381-384
- https://doi.org/10.1103/physrevlett.61.381
Abstract
It is shown that the coarsest discretization of positions and velocities in molecular dynamics leads to qualitatively correct transport coefficients and quantitatively predictable long-time tails in the velocity autocorrelation function, but requires orders of magnitude less computer time than standard molecular-dynamics methods.Keywords
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