Research data underlying the manuscript "Classification of Doubly Excited Molecular Electronic States" by M. T. do Casal, J. M. Toldo, M. Barbatti and F. Plasser.
Research data underlying the manuscript "Classification of Doubly Excited Molecular Electronic States" by M. T. do Casal, J. M. Toldo, M. Barbatti and F. Plasser. Content: Single point calculations were performed on the systems below. Each molecule folder contains subfolders with inputs a...
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| Main Authors: | , |
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| Format: | Data Data |
| Published: |
2023
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| Subjects: | |
| Online Access: | https://dx.doi.org/10.17028/rd.lboro.22303765.v1 |
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