MD Computational Approach to Elucidate Thermal Conduction in Polymers
Author:
Affiliation:
1. Faculty of Engineering, The University of Tokyo
Publisher
Institute of Electrical Engineers of Japan (IEE Japan)
Link
https://www.jstage.jst.go.jp/article/ieejfms/144/5/144_183/_pdf
Reference8 articles.
1. (1) M. Sato : “Charge Conduction in Polymer Dielectrics: Theoretical Perspectives and First-Principle Approaches”, IEEE Trans. Dielectr. Electr. Insul., Vol. 28, No. 2, pp. 520-540 (2021)
2. (2) H. Suzuki, et al.: “Molecular Dynamics Study of Ionic Conduction in Epoxy Resin”, IEEE Trans. Dielectr. Electr. Insul., Vol. 29, No. 1, pp. 170-177 (2022)
3. (3) S. Plimpton : “Fast Parallel Algorithms for Short-Range Molecular Dynamics”, J. Comput. Phys., Vol. 117, No. 1, pp. 1-19 (1995)
4. (4) G. A. Kaminski, et al.: “Evaluation and Reparametrization of the OPLS-AA Force Field for Proteins via Comparison with Accurate Quantum Chemical Calculations on Peptides”, J. Phys. Chem. B, Vol. 105, No. 28, pp. 6474-6487 (2001)
5. (5) S. W. I. Siu, et al.: “Optimization of the OPLS-AA Force Field for Long Hydrocarbons”, J. Chem. Theory Comput., Vol. 8, No. 4, pp. 1459-1470 (2012)
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