First-principle simulations of electronic structure in semicrystalline polyethylene
Author:
Affiliation:
1. School of Chemical Science and Engineering, Fibre and Polymer Technology, KTH Royal Institute of Technology, SE–100 44 Stockholm, Sweden
2. ABB Corporate Research, SE–721 78 Västerås, Sweden
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4983650
Reference71 articles.
1. Charge transport modeling in insulating polymers: from molecular to macroscopic scale
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4. Molecular dynamics simulations of deformation mechanisms of amorphous polyethylene
5. Density functional study of crystalline polyethylene
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