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Supporting Data for "Direct bicomponent Monte Carlo simulations for adsorption of CO2 and H2O in CALF-20 using machine learning interatomic potentials"

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Zenodo2026-10-30 更新2026-11-05 收录
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资源简介:

Input, output, and workflow files for "Direct bicomponent Monte Carlo simulations for adsorption of CO2 and H2O in CALF-20 using machine learning interatomic potentials"

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Zenodo
创建时间:
2026-10-29
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