5,314 datasets found

Mathematica file and dataset to reproduce the results in "Quantum fluctuations in one-dimensional supersolids". The Mathematica file "Quantumfluctuations.nb" created with...

Pre-trained and fine-tuned ANI models using the Gaussian Moments Neural Network (GM-NN) approach. Code for GM-NN implemented within the Tensorflow framework, including the...

Mathematica file and dataset to reproduce the results in "Ground-state stability and excitation spectrum of a one-dimensional dipolar supersolid". The Mathematica file...

This dataset includes the geometrical data for the Rydberg complexes depicted in Figures 5-10 of the paper "Functional completeness of planar Rydberg blockade structures". File...

Simulations and data analysis scripts for the publication "Assessing the validity of NMR relaxation rates obtained from coarse-grained simulations". The dataset contains two...

This dataset contains simulation input files for GROMACS (topologies, index, simulation parameters, starting frames, run script) to be able to reproduce the data in the...

Data for the publication Thermodynamic properties on the homologous temperature scale from direct upsampling: Understanding electron-vibration coupling and thermal vacancies in...

With the use of optical microscopy, microfluidic experiments took place in quasi-2D artificial porous media for a variety of cyclic displacement processes and boundary...

This dataset includes simulation data and jupyter notebooks used to reproduce the results in "Absorbing State Phase Transition with Clifford Circuits". The different folders...

Facilitated water permeation through narrow biological channels is fundamental for all forms of life. This process involves dehydration of bulk water entering the single-file...

We ran different fractions of the combination technique scenario described in the publication, also widely-distributed between the two machines SuperMUC-NG (file suffix `_ng`)...

This dataset contains 12 micro X-ray Computed Tomography (micro-XRCT) data sets from scans of cylindrical particulate mixture samples (diameter 80 mm; unloaded height 80 mm)...

This dataset contains 8 micro X-ray Computed Tomography (micro-XRCT) data sets from scans of cylindrical particulate mixture samples (diameter 80 mm; unloaded height 80 mm)...

This dataset contains the experimental results and postprocessing script (Matlab, Mathworks, Natick, MA) to obtain the plots and results described in the paper "Bioinspired...

Data for the publication "Performance of two complementary machine-learned potentials in modelling chemically complex systems", npj. Comp. Mat. This data set contains the...

This is the repository holding the inputs for atomistic Molecular Dynamics Simulations of nano-confined mica slabs as well as the outputs for cDFT calculations. Also, scripts...

Total interference reflection fluorescence microscopy (TIRF) of lipid bilayers is an effective technique for studying the lateral motion and ion channel activity of individual...

These are input, processing, and output files for experiments that were performed exclusively for my dissertation "Stable and mass-conserving high-dimensional simulations with...

This data set contains directly determined complex Poisson's ratio from axial and transversal strain measurements. Here, the axial and transverse strains were measured locally...

Data for the publication, Dynamically stabilized phases with full ab initio accuracy: Thermodynamics of Ti, Zr, Hf with a focus on the hcp-bcc transition, Phys. Rev. B 108,...