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This is the Data Repository of the University of Stuttgart.

SFB 1313 "Interface-Driven Multi-Field Processes in Porous Media"

SFB 1333 "Molecular heterogeneous catalysis in confined geometries"

Institute of Biochemistry

Institute of Applied Mechanics (MIB)

Institute of Thermodynamics and Thermal Process Engineering

Stuttgart Center for Simulation Science (SC SimTech)

Cluster of Excellence Integrative Computational Design and Construction for Architecture (EXC IntCDC)

SFB/Transregio 161 "Quantitative Methods for Visual Computing"

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1,711 to 1,720 of 1,830 Results

Data for: Electrohydrodynamic simulation of electrically controlled droplet generation Apr 29, 2021 - Subarea A5 Quedraogo, Yun, 2021, "Data for: Electrohydrodynamic simulation of electrically controlled droplet generation", https://doi.org/10.18419/DARUS-1793, DaRUS, V1 Im Rahmen des Projekts A5 entstanden folgende Ergebnisse numerischer Analysen zu elektrisch induzierter Ablösung von Wassertropfen mit niedriger Leitfähigkeit von der Spitze einer benetzbaren Spitze. Der Aufbau des numerischen Modells entspricht dem des elektrisch-getriebenen Tröpfchengenerators, Teilprojekt B2, zur Untersuchung der Tröpfcheninjekt...
Supplementary material for 'Confined Ru‐catalysts in a Two‐phase Heptane/Ionic Liquid Solution: Modeling Aspects' Apr 29, 2021 - Molecular Simulation Kobayashi, Takeshi; Kraus, Hamzeh; Hansen, Niels; Fyta, Maria, 2021, "Supplementary material for 'Confined Ru‐catalysts in a Two‐phase Heptane/Ionic Liquid Solution: Modeling Aspects'", https://doi.org/10.18419/DARUS-1138, DaRUS, V1 This dataset contains simulation input files in GROMACS format accompanying the mentioned publication. Structure, topology, and simulation parameter-files are provided for the simulations discussed in the paper. The data of the final NVT production simulation run are stored for the two phase, bulk and pore systems.
MUSE Datenset Apr 28, 2021 - MUSE Barzen, Johanna; Bühler, Fabian; Leymann, Frank, 2021, "MUSE Datenset", https://doi.org/10.18419/DARUS-1805, DaRUS, V1 Datensatz des MUSE Projekts: MUSE hat zum Ziel, Konventionen, die sich im Film entwickelt haben, um mittels Filmkostümen beispielsweise Stereotypen, Charaktereigenschaften, etc. zu kommunizieren, zu identifizieren und diese als eine Mustersprache für Kostüme darzustellen um das Verständnis filmisch vestimentärer Kommunikation zu schärfen. Siehe: MU...
Data for: "Synthesis of trans-Isotactic Poly(norbornene)s through Living Ring-Opening Metathesis Polymerization Initiated by Group VI Imido Alkylidene N-Heterocyclic Carbene Complexes" Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF Benedikter, Mathis, 2021, "Data for: "Synthesis of trans-Isotactic Poly(norbornene)s through Living Ring-Opening Metathesis Polymerization Initiated by Group VI Imido Alkylidene N-Heterocyclic Carbene Complexes"", https://doi.org/10.18419/DARUS-1700, DaRUS, V1 All primary data files for the publication can be found here. Procedures, reaction conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Nuclear magnetic resonance (NMR) Spectra are named according to the numbering in the publication. ¹H-NMR, ¹⁹F-NMR and ¹³C-NMR spect...
Data for: "Cationic Group VI Metal Imido Alkylidene N‐Heterocyclic Carbene Nitrile Complexes: Bench‐Stable, Functional‐Group‐Tolerant Olefin Metathesis Catalysts" Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF Benedikter, Mathis, 2021, "Data for: "Cationic Group VI Metal Imido Alkylidene N‐Heterocyclic Carbene Nitrile Complexes: Bench‐Stable, Functional‐Group‐Tolerant Olefin Metathesis Catalysts"", https://doi.org/10.18419/DARUS-1698, DaRUS, V1 All primary data files related to the publication. Procedures, recation conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Productivities in olefin metathesis reactions were examined via gas-chromatography / mass spectrometry (GC-MS) analysis and can be found in th...
Data for: "Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes Containing Pyrrolide Ligands: Access to Catalysts with Sterically Demanding Alkoxides" Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF Benedikter, Mathis; Elser, Iris, 2021, "Data for: "Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes Containing Pyrrolide Ligands: Access to Catalysts with Sterically Demanding Alkoxides"", https://doi.org/10.18419/DARUS-1699, DaRUS, V1 All primary data files related to the publication. Procedures, recation conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Productivities in olefin metathesis reactions were examined via gas-chromatography / mass spectrometry (GC-MS) analysis and can be found in th...
Data for: "Origin and Use of Hydroxyl Group Tolerance in Cationic Molybdenum Imido Alkylidene N‐Heterocyclic Carbene Catalysts" Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF Schowner, Roman; Elser, Iris; Benedikter, Mathis, 2021, "Data for: "Origin and Use of Hydroxyl Group Tolerance in Cationic Molybdenum Imido Alkylidene N‐Heterocyclic Carbene Catalysts"", https://doi.org/10.18419/DARUS-1702, DaRUS, V1 Primary data files related to the publication. Procedures, recation conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Productivities in olefin metathesis reactions were examined via gas-chromatography / mass spectrometry (GC-MS) analysis and can be found in the GC...
Chromium(VI) Bisimido Dichloro, Bisimido Alkylidene, and Chromium(V) Bisimido Iodo N‐Heterocyclic Carbene Complexes Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF Panyam, Pradeep Kumar Reddy; Stöhr, Laura; Wang, Dongren; Frey, Wolfgang; Buchmeiser, Michael, 2021, "Chromium(VI) Bisimido Dichloro, Bisimido Alkylidene, and Chromium(V) Bisimido Iodo N‐Heterocyclic Carbene Complexes", https://doi.org/10.18419/DARUS-1686, DaRUS, V1 Reaction of CrCl2(N-tBu)2 with 1,3-dimethylimidazol-2-ylidene (IMe), 1,3-dimethyl-4,5-dichloroimidazol-2-ylidene (IMeCl2), 1,3-di(2-propyl)imidazol-2-ylidene (IPr), 1,3-dimesitylimidazol-2-ylidene (IMes) and 1,3-bis(2,6-(2-Pr)2C6H3)imidazol-2-ylidene (IDipp) yields the corresponding N-heterocyclic carbene (NHC) adducts CrCl2(IMe)(N-tBu)2 (1), CrCl2...
Publication data for: "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions", data from Kästner group Apr 20, 2021 - SFB 1333 C4 - Kästner group, ITheoC Gugeler, Katrin; Kästner, Johannes, 2021, "Publication data for: "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions", data from Kästner group", https://doi.org/10.18419/DARUS-1251, DaRUS, V1 This dataset includes all relevant files from all theoretical calculations at DFT level and semi-empirical GFN2-xTB level. The file "complex_solvation.tgz" includes all calculations for the solvation of the dimeric complexes with water. That includes geometry optimizations. The file "1_4_addition.tgz" includes all calculations for the 1,4-addition...
Catalysis Data and NMR Characterization of all Compounds for "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions" Apr 19, 2021 - SFB 1333 B3 - Laschat group, IOC Kirchhof, Manuel, 2021, "Catalysis Data and NMR Characterization of all Compounds for "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions"", https://doi.org/10.18419/DARUS-1250, DaRUS, V1 In this dataset HPLC (high performance liquid chromatography) chromatograms of the products of the rhodium-catalyzed 1,2-addition and the respective examinations of the nonlinear and nonlinear-like effect (HPLC 1.2-Addition; HPLC-Messungen NLE und NLLE) and gas chromatograms of the products of the rhodium-catalyzed 1,4-addition (GC-Analytik) are li...

Data for: Electrohydrodynamic simulation of electrically controlled droplet generation

Apr 29, 2021 - Subarea A5

Quedraogo, Yun, 2021, "Data for: Electrohydrodynamic simulation of electrically controlled droplet generation", https://doi.org/10.18419/DARUS-1793, DaRUS, V1

Im Rahmen des Projekts A5 entstanden folgende Ergebnisse numerischer Analysen zu elektrisch induzierter Ablösung von Wassertropfen mit niedriger Leitfähigkeit von der Spitze einer benetzbaren Spitze. Der Aufbau des numerischen Modells entspricht dem des elektrisch-getriebenen Tröpfchengenerators, Teilprojekt B2, zur Untersuchung der Tröpfcheninjekt...

Supplementary material for 'Confined Ru‐catalysts in a Two‐phase Heptane/Ionic Liquid Solution: Modeling Aspects'

Apr 29, 2021 - Molecular Simulation

Kobayashi, Takeshi; Kraus, Hamzeh; Hansen, Niels; Fyta, Maria, 2021, "Supplementary material for 'Confined Ru‐catalysts in a Two‐phase Heptane/Ionic Liquid Solution: Modeling Aspects'", https://doi.org/10.18419/DARUS-1138, DaRUS, V1

This dataset contains simulation input files in GROMACS format accompanying the mentioned publication. Structure, topology, and simulation parameter-files are provided for the simulations discussed in the paper. The data of the final NVT production simulation run are stored for the two phase, bulk and pore systems.

MUSE Datenset

Apr 28, 2021 - MUSE

Barzen, Johanna; Bühler, Fabian; Leymann, Frank, 2021, "MUSE Datenset", https://doi.org/10.18419/DARUS-1805, DaRUS, V1

Datensatz des MUSE Projekts: MUSE hat zum Ziel, Konventionen, die sich im Film entwickelt haben, um mittels Filmkostümen beispielsweise Stereotypen, Charaktereigenschaften, etc. zu kommunizieren, zu identifizieren und diese als eine Mustersprache für Kostüme darzustellen um das Verständnis filmisch vestimentärer Kommunikation zu schärfen. Siehe: MU...

Data for: "Synthesis of trans-Isotactic Poly(norbornene)s through Living Ring-Opening Metathesis Polymerization Initiated by Group VI Imido Alkylidene N-Heterocyclic Carbene Complexes"

Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF

Benedikter, Mathis, 2021, "Data for: "Synthesis of trans-Isotactic Poly(norbornene)s through Living Ring-Opening Metathesis Polymerization Initiated by Group VI Imido Alkylidene N-Heterocyclic Carbene Complexes"", https://doi.org/10.18419/DARUS-1700, DaRUS, V1

All primary data files for the publication can be found here. Procedures, reaction conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Nuclear magnetic resonance (NMR) Spectra are named according to the numbering in the publication. ¹H-NMR, ¹⁹F-NMR and ¹³C-NMR spect...

Data for: "Cationic Group VI Metal Imido Alkylidene N‐Heterocyclic Carbene Nitrile Complexes: Bench‐Stable, Functional‐Group‐Tolerant Olefin Metathesis Catalysts"

Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF

Benedikter, Mathis, 2021, "Data for: "Cationic Group VI Metal Imido Alkylidene N‐Heterocyclic Carbene Nitrile Complexes: Bench‐Stable, Functional‐Group‐Tolerant Olefin Metathesis Catalysts"", https://doi.org/10.18419/DARUS-1698, DaRUS, V1

All primary data files related to the publication. Procedures, recation conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Productivities in olefin metathesis reactions were examined via gas-chromatography / mass spectrometry (GC-MS) analysis and can be found in th...

Data for: "Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes Containing Pyrrolide Ligands: Access to Catalysts with Sterically Demanding Alkoxides"

Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF

Benedikter, Mathis; Elser, Iris, 2021, "Data for: "Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes Containing Pyrrolide Ligands: Access to Catalysts with Sterically Demanding Alkoxides"", https://doi.org/10.18419/DARUS-1699, DaRUS, V1

Data for: "Origin and Use of Hydroxyl Group Tolerance in Cationic Molybdenum Imido Alkylidene N‐Heterocyclic Carbene Catalysts"

Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF

Schowner, Roman; Elser, Iris; Benedikter, Mathis, 2021, "Data for: "Origin and Use of Hydroxyl Group Tolerance in Cationic Molybdenum Imido Alkylidene N‐Heterocyclic Carbene Catalysts"", https://doi.org/10.18419/DARUS-1702, DaRUS, V1

Primary data files related to the publication. Procedures, recation conditions and used analytical equipment is discussed in detail in the experimental section or the supporting information of the paper. Productivities in olefin metathesis reactions were examined via gas-chromatography / mass spectrometry (GC-MS) analysis and can be found in the GC...

Chromium(VI) Bisimido Dichloro, Bisimido Alkylidene, and Chromium(V) Bisimido Iodo N‐Heterocyclic Carbene Complexes

Apr 22, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF

Panyam, Pradeep Kumar Reddy; Stöhr, Laura; Wang, Dongren; Frey, Wolfgang; Buchmeiser, Michael, 2021, "Chromium(VI) Bisimido Dichloro, Bisimido Alkylidene, and Chromium(V) Bisimido Iodo N‐Heterocyclic Carbene Complexes", https://doi.org/10.18419/DARUS-1686, DaRUS, V1

Reaction of CrCl2(N-tBu)2 with 1,3-dimethylimidazol-2-ylidene (IMe), 1,3-dimethyl-4,5-dichloroimidazol-2-ylidene (IMeCl2), 1,3-di(2-propyl)imidazol-2-ylidene (IPr), 1,3-dimesitylimidazol-2-ylidene (IMes) and 1,3-bis(2,6-(2-Pr)2C6H3)imidazol-2-ylidene (IDipp) yields the corresponding N-heterocyclic carbene (NHC) adducts CrCl2(IMe)(N-tBu)2 (1), CrCl2...

Publication data for: "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions", data from Kästner group

Apr 20, 2021 - SFB 1333 C4 - Kästner group, ITheoC

Gugeler, Katrin; Kästner, Johannes, 2021, "Publication data for: "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions", data from Kästner group", https://doi.org/10.18419/DARUS-1251, DaRUS, V1

This dataset includes all relevant files from all theoretical calculations at DFT level and semi-empirical GFN2-xTB level. The file "complex_solvation.tgz" includes all calculations for the solvation of the dimeric complexes with water. That includes geometry optimizations. The file "1_4_addition.tgz" includes all calculations for the 1,4-addition...

Catalysis Data and NMR Characterization of all Compounds for "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions"

Apr 19, 2021 - SFB 1333 B3 - Laschat group, IOC

Kirchhof, Manuel, 2021, "Catalysis Data and NMR Characterization of all Compounds for "Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions"", https://doi.org/10.18419/DARUS-1250, DaRUS, V1

In this dataset HPLC (high performance liquid chromatography) chromatograms of the products of the rhodium-catalyzed 1,2-addition and the respective examinations of the nonlinear and nonlinear-like effect (HPLC 1.2-Addition; HPLC-Messungen NLE und NLLE) and gas chromatograms of the products of the rhodium-catalyzed 1,4-addition (GC-Analytik) are li...

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