Chain motion in an unentangled polyethylene melt: A critical test of the rouse model by molecular dynamics simulations and neutron spin echo spectroscopy
- W. Paul
- G.D. Smith
- et al.
- 1998
- Physical Review Letters
Publications
This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.
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6 results for W. Paul
Conformations, order, and dynamics of polymethylene and polyoxyethylene chains in the melts from molecular dynamics simulations
- D.Y. Yoon
- G.D. Smith
- et al.
- 1995
- SPE ANTEC 1995
Static and dynamic properties of a n-C100H202 melt from molecular dynamics simulations
- W. Paul
- Grant D. Smith
- et al.
- 1997
- Macromolecules
Local dynamics in a long-chain alkane melt from molecular dynamics simulations and neutron scattering experiments
- Grant D. Smith
- Wolfgang Paul
- et al.
- 1997
- Journal of Chemical Physics
Stochastic phase space dynamics with constraints for molecular systems
- W. Paul
- D.Y. Yoon
- 1995
- Physical Review E
An optimized united atom model for simulations of polymethylene melts
- Wolfgang Paul
- Do Y. Yoon
- et al.
- 1995
- The Journal of Chemical Physics