Development of ReaxFF Reactive Force Field for Aqueous Iron-Sulfur Clusters with Applications to Stability and Reactivity in Water.

J Chem Inf Model · 2021 · PMC8028049 · PMID 33617718

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closest p

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a clear trendno p-value reported

A clear trend emerges and suggests that approximately only half of the hydrogen bonds with the cluster remain at higher temperatures.

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