Frontier molecular orbital energies and global reactivity descriptors calculated by using DFT analysis.
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https://figshare.com/articles/dataset/Frontier_molecular_orbital_energies_and_global_reactivity_descriptors_calculated_by_using_DFT_analysis_/30640855
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资源简介：
Frontier molecular orbital energies and global reactivity descriptors calculated by using DFT analysis.
创建时间：
2025-11-17
