Dataset for Origin of Heating-Induced Softening and Enthalpic Reinforcement in Elastomeric Nanocomposites - Figure 1 - Render of a filled elastomer configuration

Published: 5 March 2026| Version 1 | DOI: 10.17632/vrd38jc7hp.1
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Description

Rendering of a configuration of model filled elastomer with loading of 150 parts per hundred rubber (PHR) or 0.415 filler volume fraction. Polymers are rendered in green (with bonds shown); beads that comprise filler particles are rendered in pale yellow. Rendered by OVITO. Dataset for Kawak, Bhapkar, Simmons. Origin of Heating-Induced Softening and Enthalpic Reinforcement in Elastomeric Nanocomposites. ACS Macro Letters 2025, 14, 12, 1867–1873 DOI:10.1021/acsmacrolett.5c00442

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Steps to reproduce

Run OVITO binary with fig-np7_150phr.ovito as a command line argument to create fig-np7_150phr.png.

Institutions

Categories

Molecular Mechanics with Molecular Dynamics, Elastomeric-Based Composite, Polymer Nanocomposites, Mechanical Deformation, Young's Modulus

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