Publication data for: "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" - data from Kästner group - Dataset - B2FIND

Dataset

Publication data for: "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" - data from Kästner group

DOI

All primary data files and processed data of the journal article from Kästner group. Turbomole input and output files for all calculations used in the paper, one directory per case.

Identifier
DOI	https://doi.org/10.18419/darus-1459
Related Identifier	https://doi.org/10.1021/acs.jpca.0c06887
Metadata Access	https://darus.uni-stuttgart.de/oai?verb=GetRecord&metadataPrefix=oai_datacite&identifier=doi:10.18419/darus-1459

Provenance
Creator	Dietrich, Carolin; Schuldt, Robin ; Born, Daniel; Solodenko, Helena; Schmitz, Guido ; Kästner, Johannes
Publisher	DaRUS
Contributor	Dietrich, Carolin
Publication Year	2021
Funding Reference	DFG 358283783 - SFB 1333
Rights	CC BY 4.0; info:eu-repo/semantics/openAccess; http://creativecommons.org/licenses/by/4.0
OpenAccess	true
Contact	Dietrich, Carolin (Universität Stuttgart)

Representation
Resource Type	Dataset
Format	application/zip
Size	60896651; 23976767; 1721021
Version	1.0
Discipline	Chemistry; Natural Sciences