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Note on the number dependence of nonequilibrium molecular dynamics simulations of the viscosity of structured molecules.
- Source :
- Journal of Chemical Physics; 3/15/1992, Vol. 96 Issue 6, p4814, 2p
- Publication Year :
- 1992
-
Abstract
- Nonequilibrium molecular dynamics simulations have been performed for a system of 512 four-site models representing n-butane molecules. The results are compared to simulations previously reported for 125 molecules to check a recently reported number dependence in such simulations. A small system size dependence was observed at low shear rates, but the rheological behavior is not affected. Considerably greater certainty is obtained using larger systems. [ABSTRACT FROM AUTHOR]
- Subjects :
- MOLECULAR dynamics
VISCOSITY
MOLECULES
Subjects
Details
- Language :
- English
- ISSN :
- 00219606
- Volume :
- 96
- Issue :
- 6
- Database :
- Complementary Index
- Journal :
- Journal of Chemical Physics
- Publication Type :
- Academic Journal
- Accession number :
- 7642574
- Full Text :
- https://doi.org/10.1063/1.462770