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Title: | 1a_MD_Initialization |
Authors: | Hölter, Niklas |
Keywords: | Housane EnT Energy Transfer Energy Transfer Catalysis |
Issue Date: | 29-Sep-2025 |
Publisher: | Institute of Organic Chemistry, University of Münster |
Abstract: | Optimization and high precision frequency calculation for initializing the MD simulation of 1a using milo |
URI: | https://iochem-bd.bsc.es/browse/handle/100/478877 |
Appears in Collections: | Computational Data for EnT-photocatalzyed synthesis of housanes by intramolecular [2+2] cycloaddition - DOI: 10.19061/iochem-bd-6-583 |
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https://iochem-bd.bsc.es/browse/handle/100/478877