Pivot Algorithm and Push-off Method for Efficient System Generation of All-Atom Polymer Melts: Application to Hydroxyl-Terminated Polybutadiene-Reference-Cited by-同舟云学术

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Pivot Algorithm and Push-off Method for Efficient System Generation of All-Atom Polymer Melts: Application to Hydroxyl-Terminated Polybutadiene

Published:2013-06-27 Issue:6 Volume:22 Page:344-353
ISSN:1022-1344
Container-title:Macromolecular Theory and Simulations
language:en
Short-container-title:Macromol. Theory Simul.

Author:

Fröhlich Markus G.¹,Sewell Thomas D.¹

Affiliation:

1. Department of Chemistry; University of Missouri-Columbia; Columbia MO 65211-7600 USA

Funder

U.S. Defense Threat Reduction Agency

Publisher

Wiley

Subject

Materials Chemistry,Inorganic Chemistry,Polymers and Plastics,Organic Chemistry,Condensed Matter Physics

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/mats.201300103/fullpdf

Reference79 articles.

1. Shock Waves in Polycrystalline Iron

2. Ultrahigh Strength in Nanocrystalline Materials Under Shock Loading

3. Shock Waves in High-Energy Materials: The Initial Chemical Events in Nitramine RDX

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1. Molecular dynamics simulations of several linear homopolymers: Assessment and comparison of shock properties;Polymer;2024-01

2. Force Field Parameters for Ammonium Perchlorate Validated Using Surface Energies and Applied to Interactions with Polymer Binder;The Journal of Physical Chemistry C;2023-09-11

3. Fully Atomistic Molecular Dynamics Simulations of Hydroxyl-Terminated Polybutadiene with Insights into Hydroxyl Aggregation;Macromolecules;2020-03-25

4. A parallel algorithm to produce long polymer chains in molecular dynamics;The Journal of Chemical Physics;2019-06-14

5. Hot Spot Interaction with Hydroxyl-Terminated Polybutadiene Binder in Energetic Composites;The Journal of Physical Chemistry C;2018-04-02

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