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Microscopic mechanism study of nitromethane oxidation: based on ReaxFF molecular dynamics simulation.

RSC Adv · 2026 · PMC13386200 · PMID 42482816

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an increasing trendno p-value reported
From the figure, it can be seen that as the temperature increased from 2400 to 3000 K, the maximum molecular numbers of both N 2 and H 2 showed an increasing trend, indicating that increasing the temperature is conducive to the progress of the nitromethane pyrolysis reaction and the generation of stable gas products.

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