First-principles and classical molecular dynamics simulation of shocked polymers

By T. R. Mattsson, J. Matthew, D. Lane, K. R. Cochrane, M. Desjarlais, A. P. Thompson, F. Pierce, Gary S. Grest. 2010

264 citations recorded by the source corpus.

Subfields: Geophysics, Materials Chemistry, Mechanics of Materials

View Paper: https://www.semanticscholar.org/paper/a8298256676e0598f69dff470ee6c64aa6deafe0

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Geophysics

1. R. Moon

In Materials Chemistry

1. John W. Gillespie
2. S. Chowdhury
3. S. Sockalingam
4. Xiawa Wu
5. Jianying He
6. Gregory M. Odegard
7. Ashlie Martini
8. Zhiliang Zhang

In Mechanics of Materials

1. John W. Gillespie
2. S. Chowdhury
3. S. Sockalingam
4. S Gowtham
5. Xiawa Wu
6. Jianying He
7. Gregory M. Odegard
8. Ashlie Martini

Citations in the corpus

• Predicting mechanical response of crosslinked epoxy using ReaxFF (2014, background): “The ReaxFF has been shown to accurately describe a wide range of carbon-based systems [10-20], including bulk polymer systems [21-23].”
• Recent advances in modeling and experiments of Kevlar ballistic fibrils, fibers, yarns and flexible woven textile fabrics – a review (2017, methodology): “Mattsson et al.(204) conducted quantum and classical MD simulations of PE under shock compression to study the accuracy of the different empirical force fields.”
• Tensile strength of Iβ crystalline cellulose predicted by molecular dynamics simulation (2014, methodology): “The simulations are performed using LAMMPS software and the ReaxFF force field (Mattsson et al. 2010) is used to describe the atomic interactions.”