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CSP Landscape Reduction: bulk urea metadynamics simulations

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Zenodo2026-07-10 更新2026-08-01 收录
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Metadynamics simulations of Urea putative crystal polymorphs from the paper: Systematic finite-temperature reduction of crystal energy landscapes, NF Francia, LS Price, J Nyman, SL Price, M Salvalaglio, Crystal Growth & Design 20 (10), 6847-6862, 2020. https://doi.org/10.1021/acs.cgd.0c00918File names adopt the naming convention used in the paper and associated supporting information. Form I, the stable crystal structure of urea at ambient conditions, is structure 98.

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2026-07-10
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