Publication data for: "Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO)3]+/0"doi:10.18419/darus-1410DaRUS2021-04-121Winkler, Mario, 2021, "Publication data for: "Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO)3]+/0"", https://doi.org/10.18419/darus-1410, DaRUS, V1Publication data for: "Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO)3]+/0"doi:10.18419/darus-1410Winkler, Mariovan Slageren, JorisRingenberg, MarkWinkler, MarioSchnierle, MarcEhrlich, FelixMehnert, Kim-IsabelleBurkhardt, LukasSheveleva, AlenaBauer, MatthiasTuna, Floriana358283783 - SFB 1333DaRUSWinkler, Mariovan Slageren, JorisWinkler, Mario2021-02-22ChemistryPhysical ChemistryAll primary data files and processed data of the journal article from all affiliated authors to reproduce all simulations and figures used in the main text and supporting information.
The data sets are sorted by the measurement technique with the raw data as given by the measurement software and the simulation/plotting/fitting files in the corresponding subfolder. All python .py and matlab .m files have relative paths and can be compiled as long as the original folder structure is remained. Some data are phased or baseline corrected but if so the raw data is also available and the treatment is depicted in the file name.
The files for MCD are in the way that the measurement with the magnetic field anti-parallel to the light beam is already subtracted from the measurement in parallel orientation.M. Winkler, M. Schnierle, F. Ehrlich, K.-I. Mehnert, D. Hunger, A.M. Sheveleva, L. Burkhardt, M. Bauer, F. Tuna, M.R. Ringenberg, J. van Slageren: Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO)3]+/0, Inorg. Chem. 2021, 60, 5, 2856-286510.1021/acs.inorgchem.0c03259M. Winkler, M. Schnierle, F. Ehrlich, K.-I. Mehnert, D. Hunger, A.M. Sheveleva, L. Burkhardt, M. Bauer, F. Tuna, M.R. Ringenberg, J. van Slageren: Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO)3]+/0, Inorg. Chem. 2021, 60, 5, 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