Fragment Molecular Orbital Based Parametrization Procedure for Mesoscopic Structure Prediction of Polymeric Materials-Reference-Cited by-同舟云学术

Fragment Molecular Orbital Based Parametrization Procedure for Mesoscopic Structure Prediction of Polymeric Materials

Published:2017-12-29 Issue:1 Volume:122 Page:338-347
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Okuwaki Koji¹,Mochizuki Yuji¹²^ORCID,Doi Hideo¹,Ozawa Taku³

Affiliation:

1. Department of Chemistry and Research Center for Smart Molecules, Faculty of Science, Rikkyo University, 3-34-1 Nishi-ikebukuro, Toshima-ku, Tokyo 171-8501, Japan

2. Institute of Industrial Science, The University of Tokyo, 4-6-1 Komaba, Meguro-ku, Tokyo 153-8505, Japan

3. JSOL Corporation, 2-5-24 Harumi, Chuo-ku, Tokyo 104-0053, Japan

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcb.7b08461

Reference53 articles.

1. The dynamic mean-field density functional method and its application to the mesoscopic dynamics of quenched block copolymer melts

2. Dynamical Mean Field Calculation of Grafting Reaction of End-Functionalized Polymer

3. Simulating Microscopic Hydrodynamic Phenomena with Dissipative Particle Dynamics

4. Dynamic Simulations of Hard-Sphere Suspensions Under Steady Shear

5. Dissipative particle dynamics with energy conservation: Modelling of heat flow

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