Conformations and structures of poly(oxyethylene) melts from molecular dynamics simulations and small-angle neutron scattering experiments
- Grant D. Smith
- Do Y. Yoon
- et al.
- 1996
- Macromolecules
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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20 results for Richard L. Jaffe
Long-Time Molecular Motions and Local Chain Dynamics in n-C44H90 Melts by Molecular Dynamics Simulations
- Grant D. Smithl
- Do Y. Yoon
- et al.
- 1995
- Macromolecules
Conformations of Perfluoropoly(oxyethylene) from Ab Initio Electronic Structure Calculations on Model Molecules
- Grant D. Smith
- Richard L. Jaffe
- et al.
- 1995
- Macromolecules
Conformations of 2,4-dichloropentane and 2,4,6-trichloroheptane and a force field for poly(vinyl chloride) based upon ab initio electronic structure calculations
- Grant D. Smith
- Peter J. Ludovice
- et al.
- 1995
- Journal of Physical Chemistry®
Conformational Characteristics of Poly(tetrafluoroethylene) Chains Based upon ab Initio Electronic Structure Calculations on Model Molecules
- Grant D. Smith
- Richard L. Jaffe
- et al.
- 1994
- Macromolecules
Conformational characteristics of dimethoxymethane based upon ab initio electronic structure calculations
- Grant D. Smith
- Richard L. Jaffe
- et al.
- 1994
- Journal of Physical Chemistry
Conformational characteristics of poly(oxymethylene) based upon ab initio electronic structure calculations on model molecules
- Grant D. Smith
- Richard L. Jaffe
- et al.
- 1994
- Journal of Physical Chemistry
Conformations and Order in Atactic Poly(vinyl chloride) Melts from Molecular Dynamics Simulations
- Grant D. Smith
- Richard L. Jaffe
- et al.
- 1993
- Macromolecules
A force field for simulations of 1,2-dimethoxyethane and poly(oxyethylene) based upon ab initio electronic structure calculations on model molecules
- Grant D. Smith
- Richard L. Jaffe
- et al.
- 1993
- Journal of Physical Chemistry
Conformations of 1,2-dimethoxyethane from ab initio electronic structure calculations
- Richard L. Jaffe
- Grant D. Smith
- et al.
- 1993
- Journal of Physical Chemistry