Accurate and Transferable Machine Learning Potential for Molecular Dynamics Simulation of Sodium Silicate Glasses.
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DOI: 10.1021/acs.jctc.3c01115
Abstract: An accurate and transferable machine learning (ML) potential for the simulation of binary sodium silicate glasses over a wide range of compositions (from 0 to 50% Na2O) was developed. The potential energy surface is approximated… read more here.
Keywords: sodium silicate; transferable machine; learning potential; silicate glasses ... See more keywords