Generation of well relaxed all atom models of stereoregular polymers: a validation of hybrid particle-field molecular dynamics for polypropylene melts of different tacticities-Reference-Cited by-同舟云学术

Generation of well relaxed all atom models of stereoregular polymers: a validation of hybrid particle-field molecular dynamics for polypropylene melts of different tacticities

Published:2020-01-25 Issue:2-3 Volume:18 Page:228-241
ISSN:1539-445X
Container-title:Soft Materials
language:en
Short-container-title:Soft Materials

Author:

De Nicola Antonio¹^ORCID,Munaò Gianmarco²³,Grizzuti Nino⁴,Auriemma Finizia⁵,De Rosa Claudio⁵,Sevink Agur⁶,Milano Giuseppe¹

Affiliation:

1. Department of Organic Material Science, Yamagata University , Yonezawa, Japan

2. Dipartimento di Chimica e Biologia “A. Zambelli”, Università di Salerno , Fisciano, Italy

3. Dipartimento di Scienze Matematiche e Informatiche, Scienze Fisiche e Scienze della Terra, Università Degli Studi di Messina , Messina, Italy

4. Dipartimento di Ingegneria Chimica, dei Materiali e della Produzione Industriale, Università di Napoli “Federico II” , Napoli, Italy

5. Dipartimento di Scienze Chimiche, Università di Napoli “Federico II” , Napoli, Italy

6. Leiden Institute of Chemistry, Leiden University , Leiden, The Netherlands

Publisher

Informa UK Limited

Subject

Condensed Matter Physics,General Materials Science,General Chemistry

Link

https://www.tandfonline.com/doi/pdf/10.1080/1539445X.2020.1716801

Reference57 articles.

1. On the Stereochemical Constitution and Nuclear Magnetic Resonance Spectra of Polypropylenes.

2. Stereochemical configurations of polypropenes by high resolution nuclear magnetic resonance

3. The effect of tacticity on the conformational properties of poly(1-olefin sulfone)s

Cited by 8 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. The Effect of Chain Tacticity on the Thermal Energy Parameters of Isotactic and Syndiotactic Polypropylene;Tikrit Journal of Engineering Sciences;2024-05-13

2. Dynamics of Syndiotactic Polypropylene;Macromolecules;2024-03-19

3. Hybrid Particle-Field Molecular Dynamics: A Primer;Comprehensive Computational Chemistry;2024

4. Weak Interactions between Poly(ether imide) and Carbon Dioxide: A Multiscale Investigation Combining Experiments, Theory, and Simulations;Macromolecules;2022-12-01

5. Understanding and Modeling Polymers: The Challenge of Multiple Scales;ACS Polymers Au;2022-11-14