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171 to 180 of 198 Results

D03: Development and realisation of validation benchmarks(Universität Stuttgart) Dec 10, 2024SFB 1313 "Interface-Driven Multi-Field Processes in Porous Media" The goal of this project is to formulate and conduct benchmarks which assist in the validation of several computational models developed within the proposed CRC. Here, the main challenge arises from the possibly large uncertainties that are present in the experimental data as well as in the simulation results. A so-called validation metric which co...
SFB 1667 - Advancing Technologies of Very Low Altitude Satellites (ATLAS)(Universität Stuttgart) Jun 20, 2025 The Collaborative Research Centre (CRC) 1667 “Advancing Technologies of Very Low Altitude Satellites (ATLAS)” addresses the fundamental scientific and engineering challenges of rendering Very Low Earth Orbit (VLEO, about 200 km to 450 km altitude) accessible. It encompasses 17 distinct scientific subprojects, which are organised into three project...
ABxM.DistributedRobotics.RP19: Agent-Based Models for a Modular Collective Robotic Construction System Jun 4, 2025 - EXC IntCDC Research Project 19 'Co-Design Methods for Developing Distributed Cooperative Multi-Robot Systems for Construction' Leder, Samuel; Menges, Achim, 2025, "ABxM.DistributedRobotics.RP19: Agent-Based Models for a Modular Collective Robotic Construction System", https://doi.org/10.18419/DARUS-4760, DaRUS, V2 ... The add-on contains three agent constructs which revolve around the agent representing the building material or the mobile robots in the modelled CRC system. The agent constructs of BuildingMaterialAgent or MobileRobotAgent are utlized for the sole purpose of architectural design while the agent construct of KCAgent can be used to also robotically plan the structure. ...
Fig4c.tab May 21, 2025 - Replication Data for: 'Single V2 defect in 4H Silicon Carbide Schottky diode at low temperature' Tabular Data - 2.0 KB - 5 Variables, 40 Observations - UNF:6:cRjRYcQJ5P15e0UrqOfolg== CRC histogram
Fig4e_lines.tab May 21, 2025 - Replication Data for: 'Single V2 defect in 4H Silicon Carbide Schottky diode at low temperature' Tabular Data - 76.5 KB - 7 Variables, 1000 Observations - UNF:6:jFNTZ1JIPizZtuMXXMCU1w== Threshold identification; lines Variable Name: Variable Name: CRC threshhold Variable Label: Variable Label: CRC threshhold
Replication Data for: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2 Nov 22, 2024 - Estes Group Estes, Deven P., 2024, "Replication Data for: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2", https://doi.org/10.18419/DARUS-4565, DaRUS, V1 Replication data for the paper: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2. Contains NMR and IR data for both the catalyst characterization (before and after catalysis) as well as the reaction NMR spectra and a table with the catalytic data summarized.
Data for Surface Immobilized Cu-1,10-Phenanthroline Complexes with α-Aminophosphonate Groups in the 5-Position as Heterogenous Catalysts for Efficient Atom-Transfer Radical Cyclizations Sep 12, 2023 - Estes Group Maier, Sarah Eleonore, 2023, "Data for Surface Immobilized Cu-1,10-Phenanthroline Complexes with α-Aminophosphonate Groups in the 5-Position as Heterogenous Catalysts for Efficient Atom-Transfer Radical Cyclizations", https://doi.org/10.18419/DARUS-3467, DaRUS, V1 The data set contains the NMR data of the new ligands and immobilized catalyst as well as examplary NMR spectra after the catalysis as used for the determination of the yield. Additionally, it contains the UV/Vis data of the free and immobilized ligand and complex, and crystallographic data of the ligand L1. For experimental details, see the linked...
Supplementary material for 'Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory' Mar 29, 2021 - Institute of Thermodynamics and Thermal Process Engineering Sauer, Elmar; Gross, Joachim, 2021, "Supplementary material for 'Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory'", https://doi.org/10.18419/DARUS-1643, DaRUS, V1 This dataset contains simulation results in ASCII format accompanying the mentioned publication. The filename is structured in the following kind: Number of the figure in which the data is shown, method of simulation (TMMC Transition Matrix Monte Carlo, DFT Density Functional Theory), adsorbate(s), temperature, poregeometry (cylindrical pore or sli...
Supplementary material for 'PoreMS: A software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions' Feb 10, 2021 - Molecular Simulation Kraus, Hamzeh, 2021, "Supplementary material for 'PoreMS: A software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions'", https://doi.org/10.18419/DARUS-1170, DaRUS, V1 This dataset contains Jupiter Notebooks and the necessary structure files needed for generating the pore systems discussed in the related publication. Additionally, high-resolution figures discussed in the paper are added.
Supplementary material for 'Olefin metathesis in confined geometries: a biomimetic approach towards selective macrocyclization' Mar 20, 2020 - Molecular Simulation Kraus, Hamzeh; Rybka, Julia, 2019, "Supplementary material for 'Olefin metathesis in confined geometries: a biomimetic approach towards selective macrocyclization'", https://doi.org/10.18419/DARUS-477, DaRUS, V2 This dataset contains simulation input files in GROMACS format accompanying the mentioned publication. Structure, topology and simulation parameter-files are provided for two simulations - an unmodified pore with a silanol surface and a modified pore with an unpolar DMDMS surface. Furthermore each pore has two catalytic centers placed point-symmetr...

D03: Development and realisation of validation benchmarks(Universität Stuttgart)

Dec 10, 2024SFB 1313 "Interface-Driven Multi-Field Processes in Porous Media"

The goal of this project is to formulate and conduct benchmarks which assist in the validation of several computational models developed within the proposed CRC. Here, the main challenge arises from the possibly large uncertainties that are present in the experimental data as well as in the simulation results. A so-called validation metric which co...

SFB 1667 - Advancing Technologies of Very Low Altitude Satellites (ATLAS)(Universität Stuttgart)

Jun 20, 2025

The Collaborative Research Centre (CRC) 1667 “Advancing Technologies of Very Low Altitude Satellites (ATLAS)” addresses the fundamental scientific and engineering challenges of rendering Very Low Earth Orbit (VLEO, about 200 km to 450 km altitude) accessible. It encompasses 17 distinct scientific subprojects, which are organised into three project...

ABxM.DistributedRobotics.RP19: Agent-Based Models for a Modular Collective Robotic Construction System

Jun 4, 2025 - EXC IntCDC Research Project 19 'Co-Design Methods for Developing Distributed Cooperative Multi-Robot Systems for Construction'

Leder, Samuel; Menges, Achim, 2025, "ABxM.DistributedRobotics.RP19: Agent-Based Models for a Modular Collective Robotic Construction System", https://doi.org/10.18419/DARUS-4760, DaRUS, V2

... The add-on contains three agent constructs which revolve around the agent representing the building material or the mobile robots in the modelled CRC system. The agent constructs of BuildingMaterialAgent or MobileRobotAgent are utlized for the sole purpose of architectural design while the agent construct of KCAgent can be used to also robotically plan the structure. ...

Fig4c.tab

May 21, 2025 - Replication Data for: 'Single V2 defect in 4H Silicon Carbide Schottky diode at low temperature'

Tabular Data - 2.0 KB - 5 Variables, 40 Observations -

CRC histogram

Fig4e_lines.tab

May 21, 2025 - Replication Data for: 'Single V2 defect in 4H Silicon Carbide Schottky diode at low temperature'

Tabular Data - 76.5 KB - 7 Variables, 1000 Observations -

Threshold identification; lines

Variable Name:

Variable Name: CRC threshhold

Variable Label:

Variable Label: CRC threshhold

Replication Data for: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2

Nov 22, 2024 - Estes Group

Estes, Deven P., 2024, "Replication Data for: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2", https://doi.org/10.18419/DARUS-4565, DaRUS, V1

Replication data for the paper: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2. Contains NMR and IR data for both the catalyst characterization (before and after catalysis) as well as the reaction NMR spectra and a table with the catalytic data summarized.

Data for Surface Immobilized Cu-1,10-Phenanthroline Complexes with α-Aminophosphonate Groups in the 5-Position as Heterogenous Catalysts for Efficient Atom-Transfer Radical Cyclizations

Sep 12, 2023 - Estes Group

Maier, Sarah Eleonore, 2023, "Data for Surface Immobilized Cu-1,10-Phenanthroline Complexes with α-Aminophosphonate Groups in the 5-Position as Heterogenous Catalysts for Efficient Atom-Transfer Radical Cyclizations", https://doi.org/10.18419/DARUS-3467, DaRUS, V1

The data set contains the NMR data of the new ligands and immobilized catalyst as well as examplary NMR spectra after the catalysis as used for the determination of the yield. Additionally, it contains the UV/Vis data of the free and immobilized ligand and complex, and crystallographic data of the ligand L1. For experimental details, see the linked...

Supplementary material for 'Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory'

Mar 29, 2021 - Institute of Thermodynamics and Thermal Process Engineering

Sauer, Elmar; Gross, Joachim, 2021, "Supplementary material for 'Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory'", https://doi.org/10.18419/DARUS-1643, DaRUS, V1

This dataset contains simulation results in ASCII format accompanying the mentioned publication. The filename is structured in the following kind: Number of the figure in which the data is shown, method of simulation (TMMC Transition Matrix Monte Carlo, DFT Density Functional Theory), adsorbate(s), temperature, poregeometry (cylindrical pore or sli...

Supplementary material for 'PoreMS: A software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions'

Feb 10, 2021 - Molecular Simulation

Kraus, Hamzeh, 2021, "Supplementary material for 'PoreMS: A software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions'", https://doi.org/10.18419/DARUS-1170, DaRUS, V1

This dataset contains Jupiter Notebooks and the necessary structure files needed for generating the pore systems discussed in the related publication. Additionally, high-resolution figures discussed in the paper are added.

Supplementary material for 'Olefin metathesis in confined geometries: a biomimetic approach towards selective macrocyclization'

Mar 20, 2020 - Molecular Simulation

Kraus, Hamzeh; Rybka, Julia, 2019, "Supplementary material for 'Olefin metathesis in confined geometries: a biomimetic approach towards selective macrocyclization'", https://doi.org/10.18419/DARUS-477, DaRUS, V2

This dataset contains simulation input files in GROMACS format accompanying the mentioned publication. Structure, topology and simulation parameter-files are provided for two simulations - an unmodified pore with a silanol surface and a modified pore with an unpolar DMDMS surface. Furthermore each pore has two catalytic centers placed point-symmetr...

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