61 to 70 of 130 Results
Apr 28, 2025 - KR-Building (EXC IntCDC)
Pan, Xinyi; Hernández, Daniel; Seifer, Philipp; Lämmel, Ralf; Staab, Steffen, 2025, "eSPARQL Implementation", https://doi.org/10.18419/DARUS-4344, DaRUS, V1, UNF:6:t0V66ThHSAjSCe2jRbbJng== [fileUNF]
This project contains the code of an implementation of the eSPARQL language, which extends SPARQL-star with a `FROM BELIEF` that allows an easy formulation of epistemic queries. Further information can be found in the README.md file. |
Apr 28, 2025 - Institute of Engineering and Computational Mechanics
Kilittuwa Gamage, Ishan Anjana; Baumann, Andreas; Sollich, Daniel; Eberhard, Peter, 2025, "Simulation Results from an SPH Approach to Model the Influence of Assist Gas Forces in Laser Cutting", https://doi.org/10.18419/DARUS-5008, DaRUS, V1
Laser Cutting Laser cutting is a non-contact thermal-based material removal method that offers various advantages over conventional machining processes. The workpiece is melted by a high-powered laser beam and the resulting melt is blown away by a jet of gas. The laser assist gas is crucial as it influences the cutting speed, edge quality, and ther... |
Apr 23, 2025 - SFB 1333 - Pluhackova Group, SimTech
Kolin, Sofia; Pluhackova, Kristyna, 2025, "Supplementary Information to "Linker-Cluster Cooperativity in Confinement of Proline- Functionalized Zr-Based Metal-Organic Frameworks and its Effect on the Organocatalytic Aldol Reaction"", https://doi.org/10.18419/DARUS-4834, DaRUS, V1
Files and structures for performing all-atom molecular dynamics simulations of UiO-67 and UiO-67-based structures filled with Methanol and reactant and product molecules. |
Apr 16, 2025 - Usability and Sustainability of Simulation Software
Tucciarone, Fabio, 2025, "Replication Data for: Greedy-kernel algorithms for data mapping in multiphysics simulations", https://doi.org/10.18419/DARUS-4790, DaRUS, V1
This data set contains all test cases and measurements referenced in the Bachelor's Thesis "Greedy-kernel algorithms for data mapping in multiphysics simulations". It also contains the modified code of preCICE and ASTE used to execute these test cases. |
Apr 16, 2025 - DBTL-Data
Hägele, Lorena; Takors, Ralf, 2025, "Raw data for: The knowledge driven DBTL cycle provides mechanistic insights while optimising dopamine production in Escherichia coli", https://doi.org/10.18419/DARUS-4714, DaRUS, V1
Dopamine is a promising organic compound with several key applications in emergency medicine, diagnosis and treatment of cancer, production of lithium anodes, and wastewater treatment. Since studies on in vivo dopamine production are limited, this study demonstrates the development and optimisation of a dopamine production strain by the help of the... |
Apr 16, 2025 - PN 3-11
Pluhackova, Kristyna; Pfaendner, Christian; Unger, Benjamin; Korn, Viktoria Helena, 2025, "Data for: ART-SM: Boosting Fragment-Based Backmapping by Machine Learning", https://doi.org/10.18419/DARUS-4134, DaRUS, V1
The simulation files, molecule topologies, and analysis workflows required to generate the results of our paper 'ART-SM: Boosting Fragment-Based Backmapping by Machine Learning' published in J. Chem. Theory Comput.. In details: simulations.tar.gz: Contains the pdb (molecular structure), xtc (trajectory), mdp (MD parameters), itp (topology), and top... |
Apr 14, 2025 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF
Altus, Kristof; Shi, Yiping; Probst, Patrick; Heaton, Jack Harry; Gyton, Matthew; Lari, Leonardo; Buchmeiser, Michael; Dyer, Philip; Weller, Andrew, 2025, "Replication data of Buchmeiser group for: "Room Temperature Ethene to Propene (ETP) Tandem Catalysis using Single Crystalline Solid-State Molecular Pre-Catalysts"", https://doi.org/10.18419/DARUS-4762, DaRUS, V1, UNF:6:HJDnGFkI2XGMd/er6VApXQ== [fileUNF]
NMR data for the complex 3[BArF4] from the paper as well as a cross metathesis product are reported, as this was our share of the paper. all data are deposited as csv and therefore should be machine readable. |
Apr 11, 2025 - DuMux
Veyskarami, Maziar; Bozkurt, Kerem; Buntic, Ivan; Chen, Zhixin; Flemisch, Bernd; Ghosh, Tufan; Gläser, Dennis; Grüninger, Christoph; Heckel, Caroline; Hommel, Johannes; Kaiser, Lars; Keim, Leon; Kelm, Mathis; Kiemle, Stefanie; Koch, Timo; Kohlhaas, Rebecca; Kostelecky, Anna Mareike; Langhans, Vivien; Lipp, David; Ospina De Los Rios, Santiago; Oukili, Hamza; Schneider, Martin; Schollenberger, Theresa; Stadler, Leopold; Utz, Martin; Wang, Yue; Weiß, Fiona; Wendel, Kai; Werner, David; Winter, Roman; Wu, Hanchuan, 2025, "DuMux 3.10.0", https://doi.org/10.18419/DARUS-4975, DaRUS, V2
Release 3.10.0 of DuMux, DUNE for Multi-{Phase, Component, Scale, Physics, ...} flow and transport in porous media. DuMux is a free and open-source simulator for flow and transport processes in and around porous media. It is based on the Distributed and Unified Numerics Environment DUNE. |
Apr 11, 2025 - Institute for Theoretical Physics III: Büchler Group
Mögerle, Johannes; Brechtelsbauer, Katharina; Gea Caballero, Ana Teresa; Prior, Javier; Emperauger, Gabriel; Bornet, Guillaume; Chen, Cheng; Lahaye, Thierry; Browaeys, Antoine; Büchler, Hans Peter, 2025, "Data for "Spin-1 Haldane phase in a chain of Rydberg atoms"", https://doi.org/10.18419/DARUS-4990, DaRUS, V1
This dataset includes files and data to reproduce the figures of "Spin-1 Haldane phase in a chain of Rydberg atoms". The `plot_data` directory contains all raw data, which are needed to reproduce the figures of the paper. This data was generated by using the TeNPy package (v0.10.0) and the pairinteraction package (v0.9.9). The `plot_scripts` direct... |
Apr 9, 2025 - PN 6A-4
Álvarez Chaves, Manuel, 2025, "Replication Data for: An entropy-based evaluation of conceptual constraints in hybrid hydrological models", https://doi.org/10.18419/DARUS-4920, DaRUS, V1, UNF:6:i3yM0uireOQetNHaTVPKfg== [fileUNF]
Hybrid Models for Hydrology This repository contains code for the paper "When physics gets in the way: an entropy-based evaluation of conceptual constraints in hybrid hydrological models" submitted to Hydrology and Earth Systems Science (HESS). In this repository we have included the 'Hy2DL' and 'unite_toolbox' libraries in the versions they used f... |
