Assessing the accuracy of excited-state geometries through optimal tuning of TD-DFT with GW

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DOI10.5281/zenodo.10636066Zenodo10636066MaRDI QIDQ6709485

Dataset published at Zenodo repository.

Author name not available (Why is that?)

Publication date: 8 February 2024

Copyright license: No records found.



This data set is a part of Supporting Info for our work entitled Assessing the accuracy of excited-state geometries through optimal tuning of TD-DFT with GW which is to be submitted to the Journal of Chemical Physics. In this data set, we provide the XYZ coordinates for the compounds studied in this work.






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