Supporting Information for Disclosing Spin-Polarized Bonds on Isolable Molecules

Description

The file corresponds to the Bachelor Thesis of Ms. Elena Paulus. It contains the xyz coordinates of all optimized structures and their corresponding electronic energy in Hartree.

Resources

Name Format Description Link
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-6921485
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-6921485

Tags

  • dft,-eda,-bonding,-spin,-multireference

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