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Updated: Jan 17, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Published on: April 12, 2019

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植物油批量异质催化选择性化在林德拉催化剂上:由反应机制支持的动力建模

Enza Pellegrino1, Katia Gallucci1, Nicoletta Cancrini1

  • 1Department of Industrial and Information Engineering and Economics, Università degli Studi dell'Aquila, Piazzale E. Pontieri 1 loc. Monteluco di Roio, 67100, L'Aquila, (AQ), Italy.

ChemistryOpen
|September 24, 2025
PubMed
概括

本研究改进了使用霍根-沃森方法对植物油异质催化选择性化 (HCSH) 的建模. 开发了一种新的运动模型,改善了对油酸生产的理解.

关键词:
霍根 - 沃森公司催化剂是一种催化剂.反应机制的反应机制.选择性化选择性化植物油是一种植物油.

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