ReaxFF+—A New Reactive Force Field Method for the Accurate Description of Ionic Systems and Its Application to the Hydrolyzation of Aluminosilicates-Reference-Cited by-同舟云学术

ReaxFF+—A New Reactive Force Field Method for the Accurate Description of Ionic Systems and Its Application to the Hydrolyzation of Aluminosilicates

Author:

Böhm Oliver¹,Pfadenhauer Stephan¹,Leitsmann Roman¹²,Plänitz Philipp¹,Schreiner Eduard³,Schreiber Michael²⁴

Affiliation:

1. AQcomputare Gesellschaft für Materialberechnung mbH, Annabergerstrasse 240, 09125 Chemnitz, Germany

2. Dresden Center for Computational Materials Science (DCMS), TU Dresden, 01069 Dresden, Germany

3. BASF SE, GMC/MM-B001, 67056 Ludwigshafen, Germany

4. Institut für Physik, Technische Universität Chemnitz, 09107 Chemnitz, Germany

Funder

Bundesministerium für Bildung und Forschung

BASF

European Commission

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

Reference44 articles.

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