Molecular simulations of gas transport in hydrogenated nitrile butadiene rubber and ethylene–propylene–diene rubber

Author:

Tan JingHua12345,Chen Chenliang12345,Liu Yiwu12345ORCID,Wu Juying6785,Wu Ding12345,Zhang Xiang12345,He Xiaoye910111213,She Zhihong12345,He Ren6785,Zhang Hailiang910111213ORCID

Affiliation:

1. Key Laboratory of Advanced Packaging Materials and Technology of Hunan Province

2. School of Packaging and Materials Engineering

3. Hunan University of Technology

4. Zhuzhou 412007

5. P. R. China

6. Institute of Systems and Engineering

7. China Academy of Engineering Physics

8. Mianyang 621000

9. Key Laboratory of Polymeric Materials and Application Technology of Hunan Province

10. Key Laboratory of Advanced Functional Polymer Materials of Colleges

11. Universities of Hunan Province

12. College of Chemistry

13. Xiangtan University

Abstract

Diffusion and sorption of five gases (H2, N2, O2, CO2, CH4) in HNBR and EPDM were explored by MD and GCMC simulations.

Funder

Natural Science Foundation of Hunan Province

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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