Data for: Magnetospectroscopic Studies of a Series of Fe(II) Scorpionate Complexes: Assessing the Relationship between Halide Identity and Zero-Field Splitting

DOI

Experimental data and software corresponding to the publication: "Magnetospectroscopic Studies of a Series of Fe(II) Scorpionate Complexes: Assessing the Relationship between Halide Identity and Zero-Field Splitting". Experimental data include: EA, FIRMS, HFEPR, magnetometry data (both susceptibility and VTVH measurements), 57Fe Mössbauer, NIR Absorption, NMR, PXRD, and X-Band EPR data. MATLAB scripts for the AOM modeling (written by Mihail Atanasov and edited by Daniel J. SantaLucia) as well as software used for LFT fitting (written by Joshua Telser) are also included.

Identifier
DOI https://doi.org/10.17617/3.XNQCUE
Metadata Access https://edmond.mpg.de/api/datasets/export?exporter=dataverse_json&persistentId=doi:10.17617/3.XNQCUE
Provenance
Creator SantaLucia, Daniel John; Devkota, Laxmi; Lindeman, Sergey V.; Ozarowski, Andrew; Krzystek, J.; Ozerov, Mykhaylo; Greer, Samuel M.; Cummins, Daniel C.; Theopold, Klaus H.; Atanasov, Mihail; Telser, Joshua; Fiedler, Adam T.
Publisher Edmond
Publication Year 2025
Funding Reference CHE-1900562; DMR-1644779; DMR-2128556; CHE-2333907; National Science Foundation; State of Florida; Max-Planck-Gesellschaft; Max Planck Institute for Chemical Energy Conversion; Max-Planck-Institut für Kohlenforschung
OpenAccess true
Contact daniel.santalucia(at)cec.mpg.de; danieljsantalucia(at)gmail.com
Representation
Language English
Resource Type Dataset
Version 1
Discipline Other