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Coordinates and output files for stationary points determined for the reaction between 1,4-ditrimethylsilyl-1,4-dihydropyridine and unsaturated nitriles.

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Zenodo2022-10-05 更新2026-06-04 收录
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https://zenodo.org/record/6655104
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资源简介:
The .zip folder contains coordinates and output files (containing energies and frequencies) of the different stationary points found for the analyzed reactions, all of them in .xyz format. IRC output files are also included.
提供机构:
Zenodo
创建时间:
2022-06-17
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