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Jülich DATA (Forschungszentrum Jülich GmbH)
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Jülich DATA is the central institutional repository for research data of Forschungszentrum Jülich.

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321 to 330 of 452 Results
Replication Data for: Formation of highly oxygenated organic molecules from the oxidation of limonene by OH radical: significant contribution of H-abstraction pathway
Jul 10, 2023 - Institute of Climate and Energy Systems – Troposphere (ICE-3)
Vereecken, Luc, 2023, "Replication Data for: Formation of highly oxygenated organic molecules from the oxidation of limonene by OH radical: significant contribution of H-abstraction pathway", https://doi.org/10.26165/JUELICH-DATA/9JVHEK, Jülich DATA, V1
Quantum chemical data used for the theoretical kinetic data, including geometries and vibrational wavenumbers at the M06-2X-D3/aug-cc-pVTZ level of theory, and energies at methodologies up to CCSD(T)/aug-cc-pVTZ
Model output from CAABA/MECCA study "Development of a multiphase chemical mechanism to improve secondary organic aerosol formation in CAABA/MECCA (version 4.5.6-rc.1)"
Jul 1, 2023 - Institute of Climate and Energy Systems – Troposphere (ICE-3)
Wieser, Felix; Taraborrelli, Domenico; Sander, Rolf, 2023, "Model output from CAABA/MECCA study "Development of a multiphase chemical mechanism to improve secondary organic aerosol formation in CAABA/MECCA (version 4.5.6-rc.1)"", https://doi.org/10.26165/JUELICH-DATA/FNT6BK, Jülich DATA, V1
This dataset includes the main data obtained during the study "Development of a multiphase chemical mechanism to improve secondary organic aerosol formation in CAABA/MECCA (version 4.5.6-rc.1)" (DOI:10.5194/gmd-2023-102). The updated model code can be found at zenodo.org (DOI:10....
Data used in: Accurate quantification of the stability of the perylene-tetracarboxylic dianhydride on Au(111) molecule-surface interface
Jun 27, 2023 - Peter Grünberg Institut – Quantum Nanoscience (PGI-3)
Ruiz, Victor G.; Wagner, Christian; Maaß, Friedrich; Arefi, Hadi H.; Stremlau, Stephan; Tegeder, Petra; Tautz, F. Stefan; Tkatchenko, Alexandre, 2023, "Data used in: Accurate quantification of the stability of the perylene-tetracarboxylic dianhydride on Au(111) molecule-surface interface", https://doi.org/10.26165/JUELICH-DATA/HQXCXC, Jülich DATA, V2
We provide here the raw data used to produce the figures in the publication Ruiz et al., Communications Chemistry (2023), DOI: 10.1038/s42004-023-00925-2
SpEx - Speech and executive function
Jun 22, 2023 - Institute of Neuroscience and Medicine – Brain and Behaviour (INM-7)
Camilleri, Julia; Weis, Susanne, 2023, "SpEx - Speech and executive function", https://doi.org/10.26165/JUELICH-DATA/CHWZDZ, Jülich DATA, V1
The goal of this study was to generate a dataset that capitalises on both the rich variety of attributes that can be found in speech as well as the modern methods that allow the extraction of such attributes. To this aim, a dataset was generated consisting of speech data from 148...
Institute of Neuroscience and Medicine – Brain and Behaviour (INM-7)(Forschungszentrum Jülich)
Jun 22, 2023
The dataverse of the Institute of Neuroscience and Medicine – Brain and Behaviour (INM-7)
Simulation data for: Pore-scale modeling of water and ion diffusion in partially saturated clays
Jun 20, 2023 - Institute of Fusion Energy and Nuclear Waste Management – Nuclear Waste Management (IFN-2)
Yang, Yuankai, 2023, "Simulation data for: Pore-scale modeling of water and ion diffusion in partially saturated clays", https://doi.org/10.26165/JUELICH-DATA/JINHGU, Jülich DATA, V1
This dataset contains a table of simulated relative effective diffusion coefficients in partially saturated clays under various conditions by a pore-scale model. In addition, the electric potential distribution and the concentration distributions of tritiated water, 22Na+ and 125...
Ernst Ruska Centre – Structural Biology (ER-C-3)(Forschungszentrum Jülich)
Jun 5, 2023
The dataverse of the Ernst Ruska Centre – Structural Biology (ER-C-3)
Atg2-C-term*Atg18 Alphafold prediction data for https://doi.org/10.1101/2022.07.26.501514
Jun 5, 2023 - Ernst Ruska Centre – Structural Biology (ER-C-3)
Mann, Daniel, 2023, "Atg2-C-term*Atg18 Alphafold prediction data for https://doi.org/10.1101/2022.07.26.501514", https://doi.org/10.26165/JUELICH-DATA/PX1GXR, Jülich DATA, V1
Inputs and outputs of the AlphaFold Multimer prediction for c-terminal Atg2 and Atg18. Raw data associated to preprint "Structural plasticity of Atg18 oligomers: organization of assembled tubes and scaffolds at the isolation membrane" https://doi.org/10.1101/2022.07.26.501514
Replication Data and Matlab Code for: StructureHyperfineRelations
May 22, 2023 - Spectroscopy
Szczuka, Conrad; Rüdiger-A. Eichel; Josef Granwehr, 2023, "Replication Data and Matlab Code for: StructureHyperfineRelations", https://doi.org/10.26165/JUELICH-DATA/UH0LM2, Jülich DATA, V1
Supporting data and scripts to the publication "Gauging the importance of structural parameters for hyperfine coupling constants in organic radicals". In the accompanying publication, we present a procedure based on a statistical approach to gauge the importance of structure para...
Spectroscopy(IET-1)
May 22, 2023Institute of Energy Technologies – Fundamental Electrochemistry (IET-1)
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