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Manuscript title: Quantification of the Helicality of Helical Molecular Orbitals
Metadata:
| Title: | metallacumulene_hf |
| Authors: | Bro-Jørgensen, William |
| Issue Date: | 6-Aug-2021 |
| Publisher: | Department of Chemistry at UCPH |
| Description: | Geometry optimization of the metallacumulene with HF and cc-pVTZ on C, H and P; SDD on Ru |
| URI: | https://os152.hpc.ku.dk/browse/handle/100/49 |
| Appears in Collections: | quantifying_helicality |
Please use this identifier to cite or link to this item:
https://iochembd.chem.ku.dk/browse/handle/100/49
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