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Manuscript title: Quantification of the Helicality of Helical Molecular Orbitals

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Title: metallacumulene_wb97xd
Authors: Bro-Jørgensen, William
Issue Date: 6-Aug-2021
Publisher: Department of Chemistry at UCPH
Description: Geometry optimization of the metallacumulene with wb97X-D and cc-pVTZ on C, H and P; SDD on Ru
URI: https://os152.hpc.ku.dk/browse/handle/100/50
Appears in Collections:quantifying_helicality



Please use this identifier to cite or link to this item: https://iochembd.chem.ku.dk/browse/handle/100/50

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