Synthesizable Two-Dimensional Haeckelites with Auxetic Behavior and Multifunctional Properties: A Computational Study Integrating Machine Learning Interatomic Potentials

Abstract

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Research context

OpenAlex topics: Machine Learning in Materials Science · Nanocluster Synthesis and Applications · 2D Materials and Applications

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Affiliations

Department of Physics, University of Tehran, North Kargar Ave., Tehran 14395-547, Iran

School of Nano Science

Institute for Research in Fundamental Sciences (IPM)

Helmholtz-Zentrum Dresden-Rossendorf, Center for Advanced Systems Understanding, Untermarkt 20, 02826 Görlitz, Germany

Dynamics of Condensed Matter and Center for Sustainable Systems Design, Theoretical Chemistry, University of Paderborn, Warburger Str. 100, D-33098 Paderborn, Germany

Center for Advanced Systems Understanding (CASUS) and Helmholtz-Zentrum Dresden-Rossendorf

Department of Chemical and Materials Engineering, New Uzbekistan University, Movarounnahr Street 1, Tashkent 100000, Uzbekistan

Funding

Iran National Science Foundation

References (91)