An Exact Algorithm to Detect the Percolation Transition in Molecular Dynamics Simulations of Cross-Linking Polymer Networks-Reference-Cited by-同舟云学术

An Exact Algorithm to Detect the Percolation Transition in Molecular Dynamics Simulations of Cross-Linking Polymer Networks

Published:2021-09-09 Issue:10 Volume:17 Page:6449-6457
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Livraghi Mattia¹^ORCID,Höllring Kevin¹^ORCID,Wick Christian R.¹²^ORCID,Smith David M.³^ORCID,Smith Ana-Sunčana¹³^ORCID

Affiliation:

1. PULS Group, Institute for Theoretical Physics and Interdisciplinary Center for Nanostructured Films (IZNF), Friedrich-Alexander Universität Erlangen-Nürnberg (FAU), Cauerstraße 3, 91058 Erlangen, Germany

2. Competence Unit for Scientific Computing (CSC), Friedrich-Alexander Universität Erlangen-Nürnberg (FAU), Martensstrasse 5a, 91058 Erlangen, Germany

3. Group of Computational Life Sciences, Division of Physical Chemistry, Ruder Bošković Institute, Bijenička 54, 10000 Zagreb, Croatia

Funder

Deutsche Forschungsgemeinschaft

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.1c00423

Reference25 articles.

1. An Investigation of Cure Induced Stresses in Low Cure Temperature Thermoset Polymer Composites

2. Molecularly imprinted polymer nanomaterials and nanocomposites by controlled/living radical polymerization