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Potentials on Elemental Systems" manuscript.</dc:description>
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 raw data for:

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          <dc:date>2025-12-15</dc:date>
          <dc:description>This dataset simple_ARES.csv was generated with the open-source cheetah simulator for didactical purposes. &#13;
&#13;
To reproduce the dataset, do the following in a python 3.12 environment:&#13;
&#13;
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&#13;
2. uv sync&#13;
&#13;
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          <dc:subject>machine learning</dc:subject>
          <dc:subject>particle accelerators</dc:subject>
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          <dc:subject>beam quality</dc:subject>
          <dc:title>A dataset for exploring regression and classification of particle accelerator control and resulting beam positions</dc:title>
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        <datestamp>2019-07-03T13:43:05Z</datestamp>
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          <dc:description>Rohdaten und Ausgewertete Messungen, die in der Publikation dargestellt sind.</dc:description>
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          <dc:title>Data publication: Towards High-Repetition Rate Petawatt Laser Experiments with Cryogenic Jets Using a Mechanical Chopper System</dc:title>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-34354</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-34330</dc:relation>
          <dc:relation>doi:10.14278/rodare.1464</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/fwi</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Syncrotron data</dc:subject>
          <dc:subject>calculated thermal evaluation</dc:subject>
          <dc:title>Data Publication: What is the speed limit of martensitic transformations?</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
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    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:729</identifier>
        <datestamp>2024-08-08T10:39:11Z</datestamp>
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          <dc:creator>Wang, Zhe</dc:creator>
          <dc:creator>Kovalev, Sergey</dc:creator>
          <dc:creator>Deinert, Jan-Christoph</dc:creator>
          <dc:date>2021-01-31</dc:date>
          <dc:description>Reserach data for Publication: Non-perturbative high-harmonic generation in the three-dimensional Dirac semimetal Cd₃As₂

DOI: 10.1038/s41467-020-16133-8</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/729</dc:identifier>
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          <dc:identifier>oai:rodare.hzdr.de:729</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>info:eu-repo/grantAgreement/EC/H2020/654220/</dc:relation>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-29646</dc:relation>
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          <dc:rights>info:eu-repo/semantics/restrictedAccess</dc:rights>
          <dc:subject>Terahertz</dc:subject>
          <dc:subject>high harmonics</dc:subject>
          <dc:subject>Dirac material</dc:subject>
          <dc:subject>carrier dynamics</dc:subject>
          <dc:subject>ultrafast</dc:subject>
          <dc:title>Research data: Non-perturbative high-harmonic generation in the three-dimensional Dirac semimetal Cd₃As₂</dc:title>
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        <datestamp>2022-08-04T09:43:06Z</datestamp>
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          <dc:creator>Schindler, Felix</dc:creator>
          <dc:creator>Eckert, Sven</dc:creator>
          <dc:creator>Zürner, Till</dc:creator>
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          <dc:creator>Vogt, Tobias</dc:creator>
          <dc:date>2022-07-21</dc:date>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-34142</dc:relation>
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          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Rayleigh-Benard Convection</dc:subject>
          <dc:subject>liquid metal</dc:subject>
          <dc:subject>low Pr</dc:subject>
          <dc:subject>cylinder</dc:subject>
          <dc:subject>Aspect Ratio 0.5</dc:subject>
          <dc:subject>Ultrasound Doppler Velocimetry</dc:subject>
          <dc:title>Data publication: Collapse of Coherent Large Scale Flow in Strongly Turbulent Liquid Metal Convection</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
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        <identifier>oai:rodare.hzdr.de:2751</identifier>
        <datestamp>2025-04-01T12:38:17Z</datestamp>
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          <dc:creator>Barnowsky, Tom</dc:creator>
          <dc:creator>Curtarolo, Stefano</dc:creator>
          <dc:creator>Krasheninnikov, Arkady</dc:creator>
          <dc:creator>Heine, Thomas</dc:creator>
          <dc:creator>Friedrich, Rico</dc:creator>
          <dc:date>2024-01-16</dc:date>
          <dc:description>This dataset includes the primary research data for the publication "Magnetic State Control of Non-van der Waals 2D Materials by Hydrogenation".</dc:description>
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          <dc:language>eng</dc:language>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>2D materials</dc:subject>
          <dc:subject>magnetism</dc:subject>
          <dc:subject>non-van der Waals compounds</dc:subject>
          <dc:subject>passivation</dc:subject>
          <dc:subject>data-driven research</dc:subject>
          <dc:subject>computational materials science</dc:subject>
          <dc:subject>high-throughput computing</dc:subject>
          <dc:title>Data publication: Magnetic State Control of Non-van der Waals 2D Materials by Hydrogenation</dc:title>
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        <identifier>oai:rodare.hzdr.de:385</identifier>
        <datestamp>2020-10-30T11:58:42Z</datestamp>
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          <dc:creator>Baraban, Larysa</dc:creator>
          <dc:date>2020-06-29</dc:date>
          <dc:description>6 supplementary videos</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/385</dc:identifier>
          <dc:identifier>10.14278/rodare.385</dc:identifier>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-31268</dc:relation>
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          <dc:title>Supplementary Video sets for the publication</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>video</dc:type>
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        <identifier>oai:rodare.hzdr.de:3233</identifier>
        <datestamp>2024-10-29T12:18:17Z</datestamp>
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          <dc:creator>Brevis, Felipe</dc:creator>
          <dc:creator>Landeros, Pedro</dc:creator>
          <dc:creator>Lindner, Jürgen</dc:creator>
          <dc:creator>Kakay, Attila</dc:creator>
          <dc:creator>Körber, Lukas</dc:creator>
          <dc:date>2024-10-17</dc:date>
          <dc:description>This archive contains the raw data as well as the Tetrax (www.tetrax.software) Jupyter notebooks to produce the data that has been analyzed and used for the manuscript: Curvature-induced parity loss and hybridization of magnons: Exploring the connection of flat and tubular magnetic shells, Physical Review B 110, 134428 (2024), published on 17 October, 2024.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3233</dc:identifier>
          <dc:identifier>10.14278/rodare.3233</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3233</dc:identifier>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39826</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39818</dc:relation>
          <dc:relation>doi:10.14278/rodare.3232</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>curvature-induced</dc:subject>
          <dc:subject>spin waves</dc:subject>
          <dc:subject>mignons</dc:subject>
          <dc:subject>hybridization</dc:subject>
          <dc:subject>parity</dc:subject>
          <dc:title>Data publication: Curvature-induced parity loss and hybridization of magnons: Exploring the connection of flat and tubular magnetic shells</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
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      <header>
        <identifier>oai:rodare.hzdr.de:2420</identifier>
        <datestamp>2023-10-11T07:02:35Z</datestamp>
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          <dc:creator>Iurchuk, Vadym</dc:creator>
          <dc:creator>Kozlov, Oleksii</dc:creator>
          <dc:creator>Sorokin, Serhii</dc:creator>
          <dc:creator>Zhou, Shengqiang</dc:creator>
          <dc:creator>Lindner, Jürgen</dc:creator>
          <dc:creator>Reshetniak, Serhii</dc:creator>
          <dc:creator>Kravets, Anatolii</dc:creator>
          <dc:creator>Polishchuk, Dmytro</dc:creator>
          <dc:creator>Korenivski, Vladislav</dc:creator>
          <dc:date>2023-08-04</dc:date>
          <dc:description>This dataset contains the experimental and analytical data used and discussed in the publication "All-Electrical Operation of a Curie Switch at Room Temperature" (Phys. Rev. Applied 20, 024009 – Published 3 August 2023).</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/2420</dc:identifier>
          <dc:identifier>10.14278/rodare.2420</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:2420</dc:identifier>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-37358</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-37306</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/fwi</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Magnetoresistance</dc:subject>
          <dc:subject>Magnetic hysteresis</dc:subject>
          <dc:subject>Vibrating sample magnetometry</dc:subject>
          <dc:subject>Spin valve</dc:subject>
          <dc:subject>Thermomagnetic effects</dc:subject>
          <dc:subject>RKKY interaction</dc:subject>
          <dc:title>Data publication: All-electrical operation of a Curie switch at room temperature</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
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    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:1856</identifier>
        <datestamp>2024-10-24T14:59:28Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-hzdr</setSpec>
        <setSpec>user-matter</setSpec>
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      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Fiedler, Lenz</dc:creator>
          <dc:creator>Moldabekov, Zhandos</dc:creator>
          <dc:creator>Shao, Xuecheng</dc:creator>
          <dc:creator>Jiang, Kaili</dc:creator>
          <dc:creator>Dornheim, Tobias</dc:creator>
          <dc:creator>Pavanello, Michele</dc:creator>
          <dc:creator>Cangi, Attila</dc:creator>
          <dc:date>2022-05-30</dc:date>
          <dc:description># Data and Scripts for "Accelerating Equilibration in First-Principles Molecular Dynamics with Orbital-Free Density Functional Theory"

This dataset contains data and calculation scripts for the publication "Boosting first-principles molecular dynamics with orbital-free density functional theory".
Its goal is to enable interested parties to reproduce the experiments we have carried out. 

## Prerequesites

The following software versions are needed for the python scripts:

- `python`: 3.8.x
- `mala`: 1.1.0 (with `dftpy` installed)

Further, make sure you have a working `Quantum ESPRESSO` and `VASP` installation and have downloaded additional 
data such as local pseudopotentials and ML models (for references, see publication).

## Contents

- `scripts/`: Example scripts for the three principal python tasks associated with out work: ML inference, trajectory
analysis and OF-DFT-MD runs (via DFTPy). The scripts are general blueprints for these experiments and can be adjusted
to perform all of the calculations given in the publication.
- `data/`: Contains raw calculation data for the three investigated systems (hydrogen, beryllium and aluminium).
Since the main goal of this work is to compare OF-DFT-MD initialized and ideal crystal structure initialized 
trajectories and inferences, each of the three system-folders contains a `MD_ideal_crystal_structure` and 
`MD_ofdft_init` folder, with ideal crystal structure and OF-DFT-MD initialized data, respectively. Therein, contents
may differ; e.g. aluminium contains DFT calculation data, for beryllium data is divided by system size and Nosé mass,
while for hydrogen data for different temperatures is given. 
</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1856</dc:identifier>
          <dc:identifier>10.14278/rodare.1856</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:1856</dc:identifier>
          <dc:relation>doi:10.1103/PhysRevResearch.4.043033</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-34767</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-34778</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39797</dc:relation>
          <dc:relation>doi:10.14278/rodare.1648</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:title>Data and Scripts for "Accelerating Equilibration in First-Principles Molecular Dynamics with Orbital-Free Density Functional Theory"</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:1645</identifier>
        <datestamp>2022-05-30T07:06:04Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-hzdr</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Thiessenhusen, Erik</dc:creator>
          <dc:creator>Hoffmann, Nico</dc:creator>
          <dc:creator>Kluge, Thomas</dc:creator>
          <dc:date>2022-05-25</dc:date>
          <dc:description>This simulated dataset consists of 48k train, 6k validation and 6k test data in the h5py file format. A small example on how to access the data is located in the python script "load_data_example.py". "all_params.h5" are the three parameters of each grating in the order sigma, g, b. "all_dist.h5" are the gratings and "all_endproduct.h5" are the 2048D lineouts of the SAXS diffraction pattern. Besides the |FFT|^2 SAXS propagator a number of pertubations were implemented in order to close the domain gap between simulation and experiment.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1645</dc:identifier>
          <dc:identifier>10.14278/rodare.1645</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:1645</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-34715</dc:relation>
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          <dc:description>This data repository contains analyzed data files of the shown figures and simulation input files.

Please see the according README.txt files in the individual directories and the original manuscript for guidance.

Manuscript title:
  All-optical structuring of laser-driven proton beam profiles

Authors:
  Lieselotte Obst, Tim Ziegler, Florian-Emanuel Brack, Joao Branco, Michael Bussmann, Thomas E. Cowan, Chandra B. Curry, Frederico Fiuza, Marco Garten, Maxence Gauthier, Sebastian Göde, Siegfried H. Glenzer, Axel Huebl, Arie Irman, Siegfried H. Glenzer, Axel Huebl, Arie Irman, Jongjin B. Kim, Thomas Kluge, Stephan Kraft, Florian Kroll, Josefine Metzkes-Ng, Richard Pausch, Irene Prencipe, Martin Rehwald, Christian Rödel, Hans-Peter Schlenvoigt, Ulrich Schramm, Karl Zeil

Submitted to:
  Nature Communications (2018)


Responsible for the data repository:
  Lieselotte Obst-Huebl, TU Dresden and HZDR
  Axel Huebl, TU Dresden and HZDR
  Tim Ziegler, TU Dresden and HZDR
  Thomas Kluge, HZDR

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          <dc:title>All-optical structuring of laser-driven proton beam profiles data sets</dc:title>
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        <datestamp>2019-09-05T11:43:19Z</datestamp>
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          <dc:creator>Debus, Alexander</dc:creator>
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          <dc:description>The input sets of the simulations as used in the publication "Circumventing the Dephasing and Depletion Limits of Laser-Wakefield Acceleration" by A. Debus et al. .

The input sets include TWEAC scenarios, the LWFA scenario and the laser-propagation scenario of Appendix D. The src-directories include custom additions to the PIConGPU source code.

The simulations were run using the beta-rc6, 0.3.1, and 0.4.0 releases of PIConGPU (see DOI: 10.5281/zenodo.591746). The input sets are shown according to the respective PIConGPU version used in the original simulation. However, for running the simulations we recommend adapting the input sets to the 0.4.0 release.</dc:description>
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          <dc:subject>Optics</dc:subject>
          <dc:subject>Photonics</dc:subject>
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          <dc:title>PIConGPU simulation settings for TWEAC</dc:title>
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          <dc:subject>laser-driven protons</dc:subject>
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          <dc:subject>spatially resolved</dc:subject>
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        <datestamp>2025-01-21T15:02:34Z</datestamp>
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The data for our NbSe2 paper were primarily collected during the beamtime starting on 2022-05-08 and 2021-08-11. Below are the specific details:

(1) Figure 1:

The data are from the beamtime starting on 2022-05-08:

File numbers 046 to 064, measured on 2022-05-09.
File numbers 093 to 108, measured on 2022-05-10.

(2) Figure 2:

he data are from the beamtime starting on 2021-08-11:

File numbers 038 to 069, measured on 2021-08-14.

files: From "038_300GHz_NbSe2-flake_WG90_gain20_2p79K_THG_20mW.0" to "069_300GHz_NbSe2-flake_WG90_gain20_44p6K_THG_21mW.0".


(3) Figure 3:

The data are also from the beamtime starting on 2021-08-11:

File numbers 01 to 22, measured on 2021-08-15.

files: From "01_Polarization_75K_W3_0_W2_45_Wsample_05.0" to "32_Polarization_4K_W3_90_W2_44_Wsample_05.0".
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          <dc:description>This repository contains the PIConGPU source code and setup files used for the "Minimizing transverse phase space effects on beam-loaded laser-wakefield accelerated electron beams" paper.</dc:description>
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This talk was given at the Teaching Machine Learning workshop at ECML-PKDD 2020. For more details and information see https://teaching-ml.github.io/2020/</dc:description>
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          <dc:creator>Friedrich, Rico</dc:creator>
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          <dc:subject>data-driven research</dc:subject>
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          <dc:title>Data publication: Ge epitaxy at ultra-low growth temperatures enabled by a pristine growth environment</dc:title>
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&#13;
&#13;
&#13;
The data can be freely re-used. Please cite:&#13;
&#13;
T. Dornheim, J. Vorberger, and M. Bonitz, Nonlinear Electronic Density Response in Warm Dense Matter, Phys. Rev. Lett. (in press), arXiv:2004.03229</dc:description>
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          <dc:description>We provide data tables for element abundances from cosmic stellar sources compared those from a heavy-element freeze-out (HEFO) nonequilibrium thermal model.</dc:description>
          <dc:description>The production of these data was supported by Polish NCN under grant No. 2021/43/P/ST2/03319, by a honorary stipend from the Foundation for Polish Science within the Alexander von Humboldt program under grant No. DPN/JJL/402-4773/2022, by the Klaus Tschira Foundation, by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) – RO 3676/7-1, project486 number 537700965, and by the European Union (ERC, ExCEED, project number 101096243).</dc:description>
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Here, only the authors of the setup are listed. PIConGPU has many more authors that can be found under: https://github.com/ComputationalRadiationPhysics/picongpu or (latest stable release: https://doi.org/10.5281/zenodo.5795557)</dc:description>
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          <dc:creator>Böhme, Maximilian</dc:creator>
          <dc:date>2021-11-19</dc:date>
          <dc:description>Average atom (AA) models allow one to efficiently compute electronic and optical properties of materials over a wide range of conditions and are often employed to interpret experimental data. However, at high pressure, predictions from AA models have been shown to disagree with results from ab initio computer simulations. We represent a new innovative AA model, AvIon, that computes the electronic eigenstates with novel boundary conditions within the ion sphere. Bound and free states are derived consistently. We drop the common AA assumption that the free-particle spectrum starts at the potential threshold, which we found to be incompatible with ab initio calculations. We perform ab initio simulations of crystalline and liquid carbon and aluminum over a wide range of densities and show that the computed band structure is in very good agreement with predictions from AvIon.</dc:description>
          <dc:description>This data-set contains all the data that has been contributed from my part to the referenced publication.</dc:description>
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          <dc:description>In high energy physics, the Higgs field couples to gauge bosons and fermions and gives mass to their elementary excitations. Experimentally, such couplings can be verified from the decay product of the Higgs boson, the scalar (amplitude) excitation of the Higgs field. In superconductors, Cooper pairs bear a certain analogy to the Higgs field. Coulomb interactions between the Cooper pairs give mass to the electromagnetic field, which leads to the Meissner effect. Additional coupling with other types of interactions or collective modes is foreseeable, and even highly probable for high-Tc superconductors, where multiple degrees of freedom are intertwined. The superconducting Higgs mode may reveal such couplings spectroscopically and uncover interactions directly relevant to Cooper pairing. To this end, we investigate the Higgs mode of several cuprate thin films using phase-resolved terahertz third harmonic generation (THG) to. In addition to the heavily damped Higgs mode itself, we observe a universal jump in the phase of the driven Higgs oscillation as well as a non-vanishing THG above Tc. These findings indicate coupling of the Higgs mode to other collective modes and a nonzero pairing amplitude above Tc. Our study demonstrates a new approach for investigating unconventional superconductivity. We foresee a fruitful future for phase-resolved spectroscopy in various superconducting systems.</dc:description>
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          <dc:subject>Superconductors</dc:subject>
          <dc:subject>terahertz</dc:subject>
          <dc:subject>Higgs</dc:subject>
          <dc:subject>Nonlinear dynamics</dc:subject>
          <dc:subject>ultrafast</dc:subject>
          <dc:title>Phase-resolved Higgs response in superconducting cuprates</dc:title>
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          <dc:relation>doi:10.14278/rodare.2676</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/ibc</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>magnons</dc:subject>
          <dc:subject>qubit</dc:subject>
          <dc:subject>ODMR</dc:subject>
          <dc:subject>BLS</dc:subject>
          <dc:title>Data for: Parametric magnon transduction to spin qubits</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:646</identifier>
        <datestamp>2021-11-02T19:11:00Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-hzdr</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
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      <metadata>
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          <dc:creator>Ellis, J. A.</dc:creator>
          <dc:creator>Cangi, A.</dc:creator>
          <dc:creator>Modine, N. A.</dc:creator>
          <dc:creator>Stephens, J. A.</dc:creator>
          <dc:creator>Thompson, A. P.</dc:creator>
          <dc:creator>Rajamanickam, S.</dc:creator>
          <dc:date>2020-12-11</dc:date>
          <dc:description>Output from electronic structure code (Quantum Espresso) that serves as training data for the machine-learning workflow of the related scientific publication (https://arxiv.org/abs/2010.04905).</dc:description>
          <dc:description>This is only a limited set of the entire output data. The remainder of the data will be made available at a later point once approval from the collaborating research institution (Sandia National Laboratories) has been granted. The source code of the associated machine learning framework will also be published at that stage.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/646</dc:identifier>
          <dc:identifier>10.14278/rodare.646</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:646</dc:identifier>
          <dc:relation>url:https://arxiv.org/abs/2010.04905</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-31857</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-31603</dc:relation>
          <dc:relation>doi:10.14278/rodare.645</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/restrictedAccess</dc:rights>
          <dc:subject>machine learning</dc:subject>
          <dc:subject>neural networks</dc:subject>
          <dc:subject>materials science</dc:subject>
          <dc:subject>density functional theory</dc:subject>
          <dc:title>Accelerating Finite-temperature Kohn-Sham Density Functional Theory with Deep Neural Networks</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
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        <identifier>oai:rodare.hzdr.de:3552</identifier>
        <datestamp>2025-01-29T12:54:14Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Schmidtpeter, Jan</dc:creator>
          <dc:creator>Das, Proloy Taran</dc:creator>
          <dc:creator>Zabila, Yevhen</dc:creator>
          <dc:creator>Schubert, Conrad</dc:creator>
          <dc:creator>Gundrum, Thomas</dc:creator>
          <dc:creator>Wondrak, Thomas</dc:creator>
          <dc:creator>Makarov, Denys</dc:creator>
          <dc:date>2025-01-28</dc:date>
          <dc:description>This entry includes the data presented in the publication "Exchange-Biased Multiring Planar Hall Magnetoresistive Sensors With Nanotesla Resolution in Nonshielded Environments"</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3552</dc:identifier>
          <dc:identifier>10.14278/rodare.3552</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3552</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-40881</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39356</dc:relation>
          <dc:relation>doi:10.14278/rodare.3551</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Magnetic Sensors</dc:subject>
          <dc:subject>Planar Hall Effect</dc:subject>
          <dc:subject>Noise Spectral Density</dc:subject>
          <dc:title>Data publication: Exchange-Biased Multiring Planar Hall Magnetoresistive Sensors With Nanotesla Resolution in Nonshielded Environments</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
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      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:330</identifier>
        <datestamp>2024-08-13T12:21:42Z</datestamp>
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      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Huang, Tao</dc:creator>
          <dc:creator>Gobeil, Sophie</dc:creator>
          <dc:creator>Wang, Xu</dc:creator>
          <dc:creator>Misko, Vyacheslav</dc:creator>
          <dc:creator>Nori, Franco</dc:creator>
          <dc:creator>Malsche, Wim de</dc:creator>
          <dc:creator>Faßbender, Jürgen</dc:creator>
          <dc:creator>Makarov, Denys</dc:creator>
          <dc:creator>Cuniberti, Gianaurelio</dc:creator>
          <dc:creator>Baraban, Larysa</dc:creator>
          <dc:date>2020-05-18</dc:date>
          <dc:description>Synthetic nano- and micromotors interact with each other and their surroundings in a complex manner. Here, we report on the anisotropy of active-passive particle interaction in a soft matter system containing an immobile yet photochemical Ag/AgCl-based Janus particle embedded in a dense matrix of passive beads in pure water. The asymmetry in the chemical gradient around the Janus particle, triggered upon visible light illumination, distorts the isotropy of the surrounding electric potential and results in the repulsion of adjacent passive beads to a certain distance away from the Janus particle. This exclusion effect is found to be anisotropic with larger distances to passive beads in front of the Ag/AgCl cap of the Janus particle. We provide insight into this phenomenon by performing the angular analysis of the radii of exclusion and tracking their time evolution at the level of a single bead. Our study provides a novel fundamental insight into the collective behavior of a complex mixture of active and passive particles and is relevant for various application scenarios, e.g., particle transport at micro- and nanoscale and local chemical sensing.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/330</dc:identifier>
          <dc:identifier>10.14278/rodare.330</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:330</dc:identifier>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-30943</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-31046</dc:relation>
          <dc:relation>doi:10.14278/rodare.329</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/fwi</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>photocatalytic reaction</dc:subject>
          <dc:subject>micro and nanomotors</dc:subject>
          <dc:subject>visible light</dc:subject>
          <dc:subject>active Janus particles</dc:subject>
          <dc:subject>spherical colloidal particles</dc:subject>
          <dc:subject>exclusion phenomena</dc:subject>
          <dc:title>Anisotropic exclusion effect between photocatalytic Ag/AgCl Janus particles and passive beads in a dense colloidal matrix</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>video</dc:type>
        </oai_dc:dc>
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    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:1206</identifier>
        <datestamp>2021-10-13T12:56:36Z</datestamp>
        <setSpec>user-hzdr</setSpec>
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      <metadata>
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          <dc:creator>Marre, Brian Edward</dc:creator>
          <dc:date>2021-10-07</dc:date>
          <dc:description>Master Thesis discussing approaches to including atomic physics in PIC simulations for transient non-thermal plasmas and developing new approaches and algorithms for doing so.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1206</dc:identifier>
          <dc:identifier>10.14278/rodare.1206</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:1206</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-33221</dc:relation>
          <dc:relation>doi:10.14278/rodare.1202</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/fwk</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>PIC</dc:subject>
          <dc:subject>atomic physics</dc:subject>
          <dc:subject>picongpu</dc:subject>
          <dc:subject>plasma</dc:subject>
          <dc:subject>Particle in Cell</dc:subject>
          <dc:subject>simulation</dc:subject>
          <dc:subject>Markov-Chain rate solver</dc:subject>
          <dc:subject>Monte-Carlo rate solver</dc:subject>
          <dc:title>Coupling of atomic states to particle in cell simulations</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>other</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:116</identifier>
        <datestamp>2019-03-06T14:02:35Z</datestamp>
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      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Huebl, Axel</dc:creator>
          <dc:creator>Rehwald, Martin</dc:creator>
          <dc:creator>Obst-Huebl, Lieselotte</dc:creator>
          <dc:creator>Ziegler, Tim</dc:creator>
          <dc:creator>Garten, Marco</dc:creator>
          <dc:creator>Widera, René</dc:creator>
          <dc:creator>Zeil, Karl</dc:creator>
          <dc:creator>Cowan, Thomas E.</dc:creator>
          <dc:creator>Bussmann, Michael</dc:creator>
          <dc:creator>Schramm, Ulrich</dc:creator>
          <dc:creator>Kluge, Thomas</dc:creator>
          <dc:date>2019-03-06</dc:date>
          <dc:description>Supplementary materials for our paper "Spectral Control via Multi-Species Effects in PW-Class Laser-Ion Acceleration".

Additional high-resolution, raw HDF5 files using the openPMD standard (DOI:10.5281/zenodo.1167843) increase simulation output data to 4.7 TByte and are available from the corresponding author upon reasonable request. </dc:description>
          <dc:description>This project received funding within the MEPHISTO project (BMBF-Förderkennzeichen 01IH16006C).</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/116</dc:identifier>
          <dc:identifier>10.14278/rodare.116</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:116</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>info:eu-repo/grantAgreement/EC/H2020/654148/</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-28969</dc:relation>
          <dc:relation>doi:10.14278/rodare.115</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/ecfunded</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/health</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by-sa/4.0/legalcode</dc:rights>
          <dc:subject>LPA</dc:subject>
          <dc:subject>laser-ion acceleration</dc:subject>
          <dc:subject>TNSA</dc:subject>
          <dc:subject>multi-species</dc:subject>
          <dc:subject>cryogenic target</dc:subject>
          <dc:subject>particle-in-cell</dc:subject>
          <dc:title>Supplementary Data: Spectral Control via Multi-Species Effects in PW-Class Laser-Ion Acceleration</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
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    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:3622</identifier>
        <datestamp>2025-10-08T07:08:15Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-crc1415</setSpec>
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      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:contributor>Nihei, Anastasiia</dc:contributor>
          <dc:contributor>Barnowsky, Tom</dc:contributor>
          <dc:contributor>Friedrich, Rico</dc:contributor>
          <dc:creator>Nihei, Anastasiia</dc:creator>
          <dc:creator>Barnowsky, Tom</dc:creator>
          <dc:creator>Friedrich, Rico</dc:creator>
          <dc:date>2025-03-10</dc:date>
          <dc:description>This dataset includes the primary research data for the publication "Non-van der Waals Heterostructures".</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3622</dc:identifier>
          <dc:identifier>10.14278/rodare.3622</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3622</dc:identifier>
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          <dc:relation>doi:10.17815/jlsrf-3-159</dc:relation>
          <dc:relation>doi:10.1021/acs.nanolett.1c03841</dc:relation>
          <dc:relation>doi:10.1002/aelm.202201112</dc:relation>
          <dc:relation>doi:10.14278/rodare.1421</dc:relation>
          <dc:relation>doi:10.14278/rodare.1852</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41082</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41218</dc:relation>
          <dc:relation>doi:10.14278/rodare.3621</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/crc1415</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/fwi</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>2D materials</dc:subject>
          <dc:subject>non-van der Waals compounds</dc:subject>
          <dc:subject>heterostructures</dc:subject>
          <dc:subject>interface design</dc:subject>
          <dc:subject>magnetism</dc:subject>
          <dc:subject>data-driven research</dc:subject>
          <dc:subject>computational materials science</dc:subject>
          <dc:subject>high-throughput computing</dc:subject>
          <dc:title>Data publication: Non-van der Waals Heterostructures</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:4041</identifier>
        <datestamp>2025-10-20T12:13:54Z</datestamp>
        <setSpec>software</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Kakay, Attila</dc:creator>
          <dc:creator>Schneider, Tobias</dc:creator>
          <dc:date>2025-10-16</dc:date>
          <dc:description>This is a mumax3 (https://mumax.github.io/) software extension to compute dispersion relations from the mumax3 simulations, especially designed to run on HPC (high-performance computing) clusters.

For details on usage or maintenance please contact Dr. Attila Kákay at a.kakay@hzdr.de</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/4041</dc:identifier>
          <dc:identifier>10.14278/rodare.4041</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:4041</dc:identifier>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41985</dc:relation>
          <dc:relation>doi:10.14278/rodare.4040</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>spin-wave dispersion</dc:subject>
          <dc:subject>mumax3</dc:subject>
          <dc:subject>Go-lang</dc:subject>
          <dc:title>Software: mumax3-dispersion for HPC</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>software</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:1511</identifier>
        <datestamp>2022-04-05T09:40:36Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-hzdr</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Steiniger, Klaus</dc:creator>
          <dc:creator>Widera, René</dc:creator>
          <dc:creator>Young, Jeff</dc:creator>
          <dc:date>2022-04-01</dc:date>
          <dc:description>Data of the PIConGPU simulations as used in the publication: EZ: An Efficient, Charge Conserving Current Deposition Algorithm for Electromagnetic Particle-In-Cell Simulations

Data overview:


	picongpu_source.zip: 
	
		source code forked from the PIConGPU mainline version 0.7.0-dev
		used input set `share/picongpu/examples/PaperThermal`
	
	
	runs_charge_conservation.zip:
	
		output including hdf5 dumps to validate charge conservation property for the PaperThermal setup (warm plasma)
	
	
	runs_performance.zip:
	
		simulation timings output for Spock CPU, Spock GPU and Summit GPU runs
	
	
	runs_profiling.zip:
	
		profile data for Spock GPU and Summit GPU runs
	
	
	runs_singleParticleTest.zip:
	
		output including hdf5 dumps to validate charge conservation property for the single particle test
	
	
	analysis_scripts.zip: 
	
		jupyter notebooks for setup and analysis of PaperThermal setup
		python script to plot charge conservation from hdf5 simulation output over time
		bash script for statistical analysis of performance runs
	
	


 

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	`cryojet_shadowgram_plugin_data.zip`: Simulation with cryojet shadowgram (Fig 4b, 4c, 4d), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`doubleslit_openpmd_data_setup.zip`: Simulation with double slit setup picture (Fig. 2), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`doubleslit_shadowgram_openpmd_data.zip`: Simulation with double slit shadowgram made with openPMD time integration (Fig. 3b), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`doubleslit_shadowgram_plugin_data.zip`: Simulation with double slit shadowgram made with plugin (Fig. 3a and 3b), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`picongpu-cryojet.zip`: PIConGPU source code for cryojet simulations
	`picongpu-doubleslit.zip`: PIConGPU source code for double slit simulations
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Notes:
 - A few energies are given as identically zero. These are not actually zero but did not converge.
 - All data is given in the units in which it appears in the paper, and columns are labelled using the same notation as in the paper.</dc:description>
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[1] Pospelov, G., Van Herck, W., Burle, J., Carmona Loaiza, J.M., Durniak, C., Fisher, J., Ganeva, M., Yurov, D., &amp; Wuttke, J. (2020). BornAgain: software for simulating and fitting grazing-incidence small-angle scattering. Journal of Applied Crystallography, 53, 262 - 276.</dc:description>
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PI: Heejae Kim, MPI for polymer research, Mainz.</dc:description>
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          <dc:creator>Kaiser, Stefan</dc:creator>
          <dc:date>2023-03-10</dc:date>
          <dc:description>Research data and metadata that was used in the corresponding publication "Fano interference between collective modes
in cuprate high-Tc superconductors" ( https://doi.org/10.1038/s41467-023-36787-4 ).</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1692</dc:identifier>
          <dc:identifier>10.14278/rodare.1692</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:1692</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>doi:10.17815/jlsrf-2-58</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-34765</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-34772</dc:relation>
          <dc:relation>doi:10.14278/rodare.1691</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/elbe</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/hzdr</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Terahertz</dc:subject>
          <dc:subject>Higgs spectroscopy</dc:subject>
          <dc:subject>ultrafast</dc:subject>
          <dc:subject>phase-resolved</dc:subject>
          <dc:subject>Superconductivity</dc:subject>
          <dc:subject>cuprates</dc:subject>
          <dc:subject>magnetic fields</dc:subject>
          <dc:subject>doping</dc:subject>
          <dc:title>Research data: Fano interference between collective modes in cuprate high-Tc superconductors</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:1286</identifier>
        <datestamp>2022-12-31T00:02:00Z</datestamp>
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        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
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          <dc:creator>Erb, Denise</dc:creator>
          <dc:creator>Perlich, Jan</dc:creator>
          <dc:creator>Roth, Stephan</dc:creator>
          <dc:creator>Röhlsberger, Ralf</dc:creator>
          <dc:creator>Schlage, Kai</dc:creator>
          <dc:date>2021-11-30</dc:date>
          <dc:description>-- raw data of GISAXS experiment

-- AFM data

-- GISAXS simulation files</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1286</dc:identifier>
          <dc:identifier>10.14278/rodare.1286</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:1286</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-33170</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-33492</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>crystal surface reconstruction</dc:subject>
          <dc:subject>nanofaceted Al₂O₃</dc:subject>
          <dc:subject>pattern formation</dc:subject>
          <dc:subject>in-situ GISAXS</dc:subject>
          <dc:subject>AFM</dc:subject>
          <dc:title>Data publication: Temperature-induced surface faceting of M-plane Al₂O₃: An in-situ GISAXS study</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
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    <record>
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        <identifier>oai:rodare.hzdr.de:3229</identifier>
        <datestamp>2024-11-18T07:22:48Z</datestamp>
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          <dc:creator>Herrer, Lucía</dc:creator>
          <dc:creator>Hlawacek, Gregor</dc:creator>
          <dc:date>2024-10-25</dc:date>
          <dc:description>All Images produced by the Helium Ion Microscope (*.czi) including the pattering files created by NPVE from FIBICS (tif and xml)</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3229</dc:identifier>
          <dc:identifier>10.14278/rodare.3229</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3229</dc:identifier>
          <dc:relation>doi:10.17815/jlsrf-3-159</dc:relation>
          <dc:relation>doi:10.1039/d4nr02680b</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39807</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39806</dc:relation>
          <dc:relation>doi:10.14278/rodare.3228</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:title>Data publication: Fabrication of palladium-enriched metallic structures by direct focused He+ and Ne+ beam nanowriting from organometallic thin films: a com- parison with Ga+ and e− beams</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>image-figure</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:121</identifier>
        <datestamp>2021-12-15T14:30:12Z</datestamp>
        <setSpec>openaire_data</setSpec>
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      </header>
      <metadata>
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          <dc:creator>Ódor, Géza</dc:creator>
          <dc:creator>Kelling, Jeffrey</dc:creator>
          <dc:date>2019-03-14</dc:date>
          <dc:description>Results of fourth-order Runge--Kutta integration of the first-order Kuramoto model in brain connectome graph.


	Awr.dat.gz : connectome graph
	Awri.dat.gz : connectome graph with inhibitory links
	ccdata.tgz : simulations data for different configurations
	(averages at top-level, single runs in folders)
	
		eERll*.dat: cube graph with random long-range links
		o.ocp-kur_{lambda}_*.dat: connectome with coupling lambda
		o.ocp-kur_{lambda}I_*.dat: connectome with inhibitory links, coupling lambda
		elo-Thr: smoothed probability distributions of avalance times
	
	
</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/121</dc:identifier>
          <dc:identifier>10.14278/rodare.121</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:121</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>arxiv:arXiv:1903.00385</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-29065</dc:relation>
          <dc:relation>doi:10.14278/rodare.120</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by-sa/4.0/legalcode</dc:rights>
          <dc:subject>Kuramoto Model, Graph, Synchronization</dc:subject>
          <dc:title>Kuramoto Model on KKI18 connectome</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:3116</identifier>
        <datestamp>2024-08-26T12:52:23Z</datestamp>
        <setSpec>openaire_data</setSpec>
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      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:contributor>Salikhov, Ruslan</dc:contributor>
          <dc:creator>Salikhov, Ruslan</dc:creator>
          <dc:creator>Ilyakov, Igor</dc:creator>
          <dc:creator>Reinold, Anneke</dc:creator>
          <dc:creator>Deinert, Jan-Christoph</dc:creator>
          <dc:creator>de Oliveira, Thales</dc:creator>
          <dc:creator>Ponomaryov, Oleksiy</dc:creator>
          <dc:creator>Prajapati, Gulloo Lal</dc:creator>
          <dc:creator>Pilch, Patrick</dc:creator>
          <dc:creator>Ghalgaoui, Ahmed</dc:creator>
          <dc:creator>Koch, Max</dc:creator>
          <dc:creator>Faßbender, Jürgen</dc:creator>
          <dc:creator>Lindner, Jürgen</dc:creator>
          <dc:creator>Wang, Zhe</dc:creator>
          <dc:creator>Kovalev, Sergey</dc:creator>
          <dc:date>2024-08-26</dc:date>
          <dc:description>Raw data for the publication titled 'Ultrafast Unidirectional Spin Hall Magnetoresistance Driven by a Terahertz Light Field,' including the data presented in Figures 2 through 4.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3116</dc:identifier>
          <dc:identifier>10.14278/rodare.3116</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3116</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>doi:10.17815/jlsrf-2-58</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39487</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-39486</dc:relation>
          <dc:relation>doi:10.14278/rodare.3115</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/elbe</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/fwi</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/telbe</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Terahertz spintronics</dc:subject>
          <dc:subject>unidirectional spin-Hall magnetoresistance</dc:subject>
          <dc:subject>terahertz second harmonic generation</dc:subject>
          <dc:subject>magnetic heterostructures</dc:subject>
          <dc:title>Data publication: Ultrafast unidirectional spin Hall magnetoresistance driven by terahertz light field</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:2720</identifier>
        <datestamp>2024-08-14T12:27:05Z</datestamp>
        <setSpec>openaire_data</setSpec>
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        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
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      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Martinetto, Vincent</dc:creator>
          <dc:creator>Shah, Karan</dc:creator>
          <dc:creator>Cangi, Attila</dc:creator>
          <dc:creator>Pribram-Jones, Aurora</dc:creator>
          <dc:date>2024-02-01</dc:date>
          <dc:description>This data repository contains the datasets used in the paper "Inverting the Kohn-Sham equations with physics-informed machine learning". 

It contains the data generation scripts, datasets for the systems used in the paper (Single Well - 1D atom, Double Well - 1D diatomic molecule) and output potentials generated by the physics-informed machine learning models (physics-informed neural networks and Fourier neural operators).</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/2720</dc:identifier>
          <dc:identifier>10.14278/rodare.2720</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:2720</dc:identifier>
          <dc:relation>doi:10.48550/arXiv.2312.15301</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-38725</dc:relation>
          <dc:relation>doi:10.14278/rodare.2719</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/casus</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/zrt</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>density functional theory</dc:subject>
          <dc:subject>machine learning</dc:subject>
          <dc:title>Inverting the Kohn-Sham equations with physics-informed machine learning</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:3706</identifier>
        <datestamp>2025-10-09T08:40:40Z</datestamp>
        <setSpec>openaire_data</setSpec>
        <setSpec>openaire_data</setSpec>
        <setSpec>openaire_data</setSpec>
        <setSpec>openaire_data</setSpec>
        <setSpec>user-fwi</setSpec>
        <setSpec>user-ibc</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
        <setSpec>user-elbe</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:contributor>Chekhonin, Paul</dc:contributor>
          <dc:contributor>Worbs, Andreas</dc:contributor>
          <dc:contributor>Hlawacek, Gregor</dc:contributor>
          <dc:contributor>Wagner, Andreas</dc:contributor>
          <dc:creator>Bektas, Umutcan</dc:creator>
          <dc:creator>Liedke, Maciej Oskar</dc:creator>
          <dc:creator>Liu, Huan</dc:creator>
          <dc:creator>Ganss, Fabian</dc:creator>
          <dc:creator>Butterling, Maik</dc:creator>
          <dc:creator>Klingner, Nico</dc:creator>
          <dc:creator>Hübner, René</dc:creator>
          <dc:creator>Makkonen, Ilja</dc:creator>
          <dc:creator>Wagner, Andreas</dc:creator>
          <dc:creator>Hlawacek, Gregor</dc:creator>
          <dc:date>2025-04-11</dc:date>
          <dc:description>In this study, we investigate the ion-induced phase transition in gallium oxide (Ga2O3) from beta- to the gamma- phase and the role of defects in the transformation and the quality of the resulting crystal structure. This upload contains XRD, TEM, RBS, PALS, DB-VEPAS and simulations.</dc:description>
          <dc:description>We acknowledge the M-ERA.NET Program for financial support via the GOFIB project supported by the tax funds on the basis of the budget passed by the Saxonian state parliament in Germany and administrated in Finland by the Academy of Finland project number 352518. 
UB, GH, and NK acknowledge support by the COST Action CA19140 FIT4NANO.
This work was partially supported by the Initiative and Networking Fund of the Helmholtz Association (FKZ VH-VI-442 Memriox) and the Helmholtz Energy Materials Characterization Platform (03ET7015). 
We are grateful for CSC-Finnish IT Center for Science for generous computational resources.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3706</dc:identifier>
          <dc:identifier>10.14278/rodare.3706</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3706</dc:identifier>
          <dc:relation>doi:10.17815/jlsrf-2-58</dc:relation>
          <dc:relation>doi:10.17815/jlsrf-3-159</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41066</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41946</dc:relation>
          <dc:relation>doi:10.14278/rodare.3705</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/elbe</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/fwi</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/ibc</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Gallium Oxide</dc:subject>
          <dc:subject>Defects in Gallium Oxide</dc:subject>
          <dc:subject>Positron Annihilation Lifetime Spectroscopy</dc:subject>
          <dc:subject>Doppler broadening spectroscopy</dc:subject>
          <dc:subject>X-ray diffraction</dc:subject>
          <dc:subject>Transmission Electron Microscopy</dc:subject>
          <dc:title>Defect Analysis of the Beta- to Gamma-Ga2O3 phase transition</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:4043</identifier>
        <datestamp>2025-10-20T12:14:18Z</datestamp>
        <setSpec>software</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Kakay, Attila</dc:creator>
          <dc:creator>Schneider, Tobias</dc:creator>
          <dc:date>2025-10-16</dc:date>
          <dc:description>This is a mumax3 (https://mumax.github.io/) software extension to compute the power spectrum from the mumax3 simulations, especially designed to run on HPC (high-performance computing) clusters.

For details on usage or maintenance please contact Dr. Attila Kákay at a.kakay@hzdr.de

This package also include the mode movie program, that can be used to recover the spatial profiles of the magnetization dynamics with a given frequency, obtained with the power spectrum computation. modemovie -h shows a help on the usage. When running the program, will ask for the frequency index that is stored in the spectrum (text file) computed by the mumax3-pwsp, and for the number of periods and number of frames in a period, for the output files that can be used to created a movie of the magnetization dynamics.

For further help and details look the source code or contact Dr. Attila Kákay at a.kakay@hzdr.de</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/4043</dc:identifier>
          <dc:identifier>10.14278/rodare.4043</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:4043</dc:identifier>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41986</dc:relation>
          <dc:relation>doi:10.14278/rodare.4042</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>magnetization dynamics</dc:subject>
          <dc:subject>power spectrum</dc:subject>
          <dc:subject>FFT</dc:subject>
          <dc:subject>mode movie</dc:subject>
          <dc:title>Software: mumax3-pwsp for HPC</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>software</dc:type>
        </oai_dc:dc>
      </metadata>
    </record>
    <record>
      <header>
        <identifier>oai:rodare.hzdr.de:340</identifier>
        <datestamp>2020-10-30T12:48:10Z</datestamp>
        <setSpec>user-hzdr</setSpec>
        <setSpec>user-matter</setSpec>
        <setSpec>user-rodare</setSpec>
      </header>
      <metadata>
        <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
          <dc:creator>Baraban, Larysa</dc:creator>
          <dc:creator>Klinghammer, Stephanie</dc:creator>
          <dc:creator>Rauch, Sebastian</dc:creator>
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          <dc:relation>doi:10.14278/rodare.2304</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>NiTi films</dc:subject>
          <dc:subject>shape memory alloys</dc:subject>
          <dc:subject>epitaxial film growth</dc:subject>
          <dc:subject>Nitinol</dc:subject>
          <dc:title>Data for "How to grow single-crystalline and epitaxial NiTi films in (100)- and (111)-orientation"</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
        </oai_dc:dc>
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        <identifier>oai:rodare.hzdr.de:413</identifier>
        <datestamp>2020-10-30T11:51:26Z</datestamp>
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          <dc:creator>Venanzi, Tommaso</dc:creator>
          <dc:creator>Arora, Himani</dc:creator>
          <dc:creator>Winnerl, Stephan</dc:creator>
          <dc:creator>Pashkin, Oleksiy</dc:creator>
          <dc:creator>Chava, Phanish</dc:creator>
          <dc:creator>Patane, Amalia</dc:creator>
          <dc:creator>Kovalyuk, Zakhar</dc:creator>
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          <dc:creator>Watanabe, Kenji</dc:creator>
          <dc:creator>Taniguchi, Takashi</dc:creator>
          <dc:creator>Erbe, Artur</dc:creator>
          <dc:creator>Helm, Manfred</dc:creator>
          <dc:creator>Schneider, Harald</dc:creator>
          <dc:date>2020-04-14</dc:date>
          <dc:description>We study the optical properties of thin flakes of InSe encapsulated in hexagonal boron nitride. Mores pecifically, we investigate the photoluminescence (PL) emission and its dependence on sample thickness and temperature. Through the analysis of the PL line shape, we discuss the relative weights of the exciton and electron-hole contributions. Thereafter we investigate the PL dynamics. Two contributions are distinguishable at low temperature: direct band-gap electron-hole and defect-assisted recombination. The two recombination processes have lifetimes ofτ1∼8ns andτ2∼100 ns, respectively. The relative weights of the direct band-gap and defect-assisted contributions show a strong layer dependence due to the direct-to-indirect band-gap crossover. Electron-hole PL lifetime is limited by population transfer to lower-energy states and no dependence on the number of layers was observed. The lifetime of the defect-assisted recombination gets longer for thinner samples. Finally, we show that the PL lifetime decreases at high temperatures as a consequence of more efficient nonradiative recombinations.</dc:description>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-30918</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-30917</dc:relation>
          <dc:relation>doi:10.14278/rodare.412</dc:relation>
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          <dc:rights>https://creativecommons.org/licenses/by/1.0/legalcode</dc:rights>
          <dc:subject>2D semiconductors</dc:subject>
          <dc:subject>time-resolved photoluminescence</dc:subject>
          <dc:title>Data for: Photoluminescence dynamics in few-layer InSe</dc:title>
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        <datestamp>2025-01-07T13:15:50Z</datestamp>
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          <dc:description>Data publication for the FEM-simulation study entitled "Design guidelines for efficient thermoelastic harvesting of low-grade waste heat" by Bruno Neumann and Sebastian Fähler. The attached archive contains a readme file to explain the structure of the data and where it can be found.</dc:description>
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        <identifier>oai:rodare.hzdr.de:1194</identifier>
        <datestamp>2021-10-05T04:25:19Z</datestamp>
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          <dc:creator>Hoffmann, Nico</dc:creator>
          <dc:date>2021-09-06</dc:date>
          <dc:description>Neural Solvers are neural network-based solvers for partial differential equations and inverse problems. The framework implements scalable physics-informed neural networks Physics-informed neural networks allow strong scaling by design. Therefore, we have developed a framework that uses data parallelism to accelerate the training of physics-informed neural networks significantly. To implement data parallelism, we use the Horovod framework, which provides near-ideal speedup on multi-GPU regimes.</dc:description>
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          <dc:subject>PINNs</dc:subject>
          <dc:subject>PDEs</dc:subject>
          <dc:subject>Neural Solver</dc:subject>
          <dc:subject>Scalable AI</dc:subject>
          <dc:title>Neural Solvers</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
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        <identifier>oai:rodare.hzdr.de:1544</identifier>
        <datestamp>2023-01-27T11:18:09Z</datestamp>
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          <dc:creator>Agarwal, Naman</dc:creator>
          <dc:creator>Deinert, Jan-Christoph</dc:creator>
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          <dc:creator>Yaroslavtsev, Alexander</dc:creator>
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          <dc:description>This repository entry contains the research data used for generating the publication "Terahertz-wave decoding of femtosecond extreme-ultraviolet light pulses".</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1544</dc:identifier>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-34564</dc:relation>
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          <dc:subject>Extreme Ultraviolet</dc:subject>
          <dc:subject>Pulse-resolved</dc:subject>
          <dc:subject>ultrafast</dc:subject>
          <dc:subject>terahertz tomography</dc:subject>
          <dc:subject>electron bunch diagnostics</dc:subject>
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        <datestamp>2024-08-09T12:42:17Z</datestamp>
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          <dc:contributor>Kovalev, Sergey</dc:contributor>
          <dc:contributor>Soavi, Giancarlo</dc:contributor>
          <dc:contributor>Klimmer, Sebastian</dc:contributor>
          <dc:creator>Deinert, Jan-Christoph</dc:creator>
          <dc:creator>Kovalev, Sergey</dc:creator>
          <dc:date>2021-06-22</dc:date>
          <dc:description>Research data from the June 2021 TELBE beamtime for scientific exchange.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1036</dc:identifier>
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          <dc:relation>url:https://rodare.hzdr.de/communities/matter</dc:relation>
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          <dc:subject>Terahrtz</dc:subject>
          <dc:subject>graphene</dc:subject>
          <dc:subject>encapsulated graphene</dc:subject>
          <dc:subject>nonlinear optics</dc:subject>
          <dc:subject>harmonic generation</dc:subject>
          <dc:title>Research data: THz harmonic generation from ultraclean graphene</dc:title>
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    <record>
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        <datestamp>2023-10-24T07:42:14Z</datestamp>
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          <dc:creator>Fähler, Sebastian</dc:creator>
          <dc:date>2023-07-12</dc:date>
          <dc:description>This dataset contains data about the epitaxial NiTi film that was used in the publication "Guided acoustic waves in thin epitaxial films: experiment and inverse problem solution for NiTi". It contains the SEM, AFM, FIB and R(T) data used to characterize the film.</dc:description>
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          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>NiTi</dc:subject>
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          <dc:title>Dataset for "Guided acoustic waves in thin epitaxial films: experiment and inverse problem solution for NiTi"</dc:title>
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    <record>
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        <datestamp>2024-08-08T10:36:21Z</datestamp>
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          <dc:creator>Tielrooij, K.-J.</dc:creator>
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          <dc:creator>Ilyakov, Igor</dc:creator>
          <dc:creator>Chen, Min</dc:creator>
          <dc:creator>Ponomaryov, Oleksiy</dc:creator>
          <dc:creator>Oliveira, Thales de</dc:creator>
          <dc:creator>Eng, L. M.</dc:creator>
          <dc:creator>Gensch, Michael</dc:creator>
          <dc:date>2021-09-09</dc:date>
          <dc:description>This research data publication contains: - Experimental datasets which were evaluated and presented in the corresponding article. - Origin software file that contains the raw data as well as the different steps of the data analysis, the results of which are presented in the article.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1150</dc:identifier>
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          <dc:identifier>oai:rodare.hzdr.de:1150</dc:identifier>
          <dc:relation>info:eu-repo/grantAgreement/EC/H2020/737038/</dc:relation>
          <dc:relation>info:eu-repo/grantAgreement/EC/H2020/804349/</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/restrictedAccess</dc:rights>
          <dc:subject>Terahertz</dc:subject>
          <dc:subject>Ultrafast</dc:subject>
          <dc:subject>Harmonic Generation</dc:subject>
          <dc:subject>Topological Insulators</dc:subject>
          <dc:subject>Surface Science</dc:subject>
          <dc:subject>Dirac Material</dc:subject>
          <dc:title>Research data: Terahertz signatures of ultrafast Dirac fermion relaxation at the surface of topological insulators</dc:title>
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        <identifier>oai:rodare.hzdr.de:4442</identifier>
        <datestamp>2026-01-26T06:56:32Z</datestamp>
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          <dc:creator>Barnowsky, Tom</dc:creator>
          <dc:creator>Christie, Madeleine</dc:creator>
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          <dc:date>2026-01-23</dc:date>
          <dc:description>Primary Research Data for "Kagome Flat Bands from Self-Assembled Water on Non–van der Waals 2D Materials"

Tom Barnowsky, Madeleine Christie, Anastasiia Nihei, and Rico Friedrich
TU Dresden &amp; Helmholtz-Zentrum Dresden-Rossendorf, Germany

This dataset contains the primary data supporting the publication "Kagome Flat Bands from Self-Assembled Water on Non–van der Waals 2D Materials".

Data Structure

The dataset is organized according to the following directory template:

.
├── binaries
│   ├── 001_facet_Al2O3_ICSD_89664_PBE_relax_ions_cell_shape
│   │   └── passivation_H2O_full
│   │       ├── aflow.in
│   │       ├── ...
│   │       └── MD_300K_PROB_0.01
│   │           ├── INCAR.xz
│   │           └── ...
│   └── ...
└── ternaries
    └── ...

The data hierarchy consists of the following levels:


	System type: `binaries` (two chemical species) versus `ternaries` (three chemical species).
	Pristine slab data: Directories of the form `001_facet_*` contain pristine slab structures from Refs. [1,2]. These directories are left empty as this data can be acquired from the associated data publications [3,4].
	H2O passivated slabs: The directories `passivation_H2O_full` contains AFLOW/VASP [5–10] input and output files for structural relaxation and electronic band structure calculations.
	Molecular dynamics simulations: The directories `MD_300K_PROB_0.01` contains VASP input and output files for molecular dynamics simulations at 300 K used to assess structural stability.


Additional electronic analysis: For KSbO3, an additional subdirectory `electronic_details` inside `passivation_H2O_full` contains charge density differences, local electrostatic potentials, and partial charge densities.

Solvation Calculations

For the 11 systems identified as dynamically stable, a duplicate of the directory tree described above is provided with the suffix `_water_solvation`. These directories contain VASPsol++ [11] solvation-corrected calculations for both pristine slabs and H2O-passivated sheets.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/4442</dc:identifier>
          <dc:identifier>10.14278/rodare.4442</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:4442</dc:identifier>
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          <dc:relation>doi:10.14278/rodare.1421</dc:relation>
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          <dc:relation>doi:10.1103/PhysRevB.47.558</dc:relation>
          <dc:relation>doi:10.1103/PhysRevB.49.16223</dc:relation>
          <dc:relation>doi:10.1088/0953-8984/6/40/015</dc:relation>
          <dc:relation>doi:10.1103/PhysRevB.54.11169</dc:relation>
          <dc:relation>doi:10.1016/0927-0256(96)00008-0</dc:relation>
          <dc:relation>doi:10.1063/5.0176308</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>2D materials</dc:subject>
          <dc:subject>passivation</dc:subject>
          <dc:subject>non-van der Waals compounds</dc:subject>
          <dc:subject>high-throughput computing</dc:subject>
          <dc:subject>flat bands</dc:subject>
          <dc:subject>kagome lattice</dc:subject>
          <dc:title>Data Publication: Kagome Flat Bands from Self-Assembled Water on Non–van der Waals 2D Materials</dc:title>
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        <datestamp>2026-03-27T13:11:08Z</datestamp>
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          <dc:description>Data to create figures for "Synthetic Optical Imaging in PIConGPU" and source code to rerun simulations. 


	`cryojet_shadowgram_plugin_data.zip`: Simulation with cryojet shadowgram (Fig 4b, 4c, 4d), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`doubleslit_openpmd_data_setup.zip`: Simulation with double slit setup picture (Fig. 2), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`doubleslit_shadowgram_openpmd_data.zip`: Simulation with double slit shadowgram made with openPMD time integration (Fig. 3b), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`doubleslit_shadowgram_plugin_data.zip`: Simulation with double slit shadowgram made with plugin (Fig. 3a and 3b), input files to rebuild and rerun simulation are in `input/include` and `input/etc`
	`picongpu-cryojet.zip`: PIConGPU source code for cryojet simulations
	`picongpu-doubleslit.zip`: PIConGPU source code for double slit simulations




Changelog 1.0.0 -&gt; 2.0.0:


	Update `cryojet_shadowgram_plugin_data.zip` for the new shadowgraphy cryojet simulation (Fig 4b, 4c, 4d)
	Removed `cryojet_openpmd_data.zip`, the density plot (Fig. 4a) is now directly created with a python script with the information from the `density.param` in `cryojet_shadowgram_plugin_data.zip`
</dc:description>
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          <dc:subject>Particle-in-Cell</dc:subject>
          <dc:subject>Laser Plasma Acceleration</dc:subject>
          <dc:subject>Shadowgraphy</dc:subject>
          <dc:subject>PIConGPU</dc:subject>
          <dc:title>Data publication: Synthetic Optical Imaging in PIConGPU</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
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          <dc:date>2021-12-22</dc:date>
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          <dc:identifier>https://rodare.hzdr.de/record/1347</dc:identifier>
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          <dc:subject>Density functional theory</dc:subject>
          <dc:subject>Electron transport properties</dc:subject>
          <dc:subject>Thermal conductivity</dc:subject>
          <dc:subject>Electrical conductivity</dc:subject>
          <dc:title>Data for "Dissociating the phononic, magnetic and electronic contributions to thermal conductivity: a computational study in α-iron"</dc:title>
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        <identifier>oai:rodare.hzdr.de:24</identifier>
        <datestamp>2020-10-20T11:18:53Z</datestamp>
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          <dc:title>Data for publication</dc:title>
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        <identifier>oai:rodare.hzdr.de:807</identifier>
        <datestamp>2024-08-13T12:15:05Z</datestamp>
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          <dc:contributor>von Borany, Johannes</dc:contributor>
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          <dc:date>2021-02-09</dc:date>
          <dc:description>Energy-filtered transmission electron microscopy (EFTEM) images of stacked Si/SiO2/Si nanopillars</dc:description>
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          <dc:title>Sub-20 nm multilayer nanopillar patterning for hybrid SET/CMOS integration: Figs. 1a, 1b and 5</dc:title>
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          <dc:creator>Deinert, Jan-Christoph</dc:creator>
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          <dc:creator>Chen, Min</dc:creator>
          <dc:creator>Bawatna, Mohammed</dc:creator>
          <dc:creator>Christiani, Georg</dc:creator>
          <dc:creator>Logvenov, Gennady</dc:creator>
          <dc:creator>Gallais, Yann</dc:creator>
          <dc:creator>Boris, Alexander V.</dc:creator>
          <dc:creator>Keimer, Bernhard</dc:creator>
          <dc:creator>Schnyder, Andreas</dc:creator>
          <dc:creator>Manske, Dirk</dc:creator>
          <dc:creator>Gensch, Michael</dc:creator>
          <dc:creator>Wang, Zhe</dc:creator>
          <dc:creator>Shimano, Ryo</dc:creator>
          <dc:creator>Kaiser, Stefan</dc:creator>
          <dc:date>2021-12-16</dc:date>
          <dc:description>In high energy physics, the Higgs field couples to gauge bosons and fermions and gives mass to their elementary excitations. Experimentally, such couplings can be verified from the decay product of the Higgs boson, the scalar (amplitude) excitation of the Higgs field. In superconductors, Cooper pairs bear a certain analogy to the Higgs field. Coulomb interactions between the Cooper pairs give mass to the electromagnetic field, which leads to the Meissner effect. Additional coupling with other types of interactions or collective modes is foreseeable, and even highly probable for high-Tc superconductors, where multiple degrees of freedom are intertwined. The superconducting Higgs mode may reveal such couplings spectroscopically and uncover interactions directly relevant to Cooper pairing. To this end, we investigate the Higgs mode of several cuprate thin films using phase-resolved terahertz third harmonic generation (THG) to. In addition to the heavily damped Higgs mode itself, we observe a universal jump in the phase of the driven Higgs oscillation as well as a non-vanishing THG above Tc. These findings indicate coupling of the Higgs mode to other collective modes and a nonzero pairing amplitude above Tc. Our study demonstrates a new approach for investigating unconventional superconductivity. We foresee a fruitful future for phase-resolved spectroscopy in various superconducting systems.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/1289</dc:identifier>
          <dc:identifier>10.14278/rodare.1289</dc:identifier>
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          <dc:relation>doi:10.1038/s41467-020-15613-1</dc:relation>
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          <dc:subject>Superconductors</dc:subject>
          <dc:subject>terahertz</dc:subject>
          <dc:subject>Higgs</dc:subject>
          <dc:subject>Nonlinear dynamics</dc:subject>
          <dc:subject>ultrafast</dc:subject>
          <dc:title>Phase-resolved Higgs response in superconducting cuprates</dc:title>
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        <datestamp>2025-07-07T06:13:02Z</datestamp>
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          <dc:creator>Ayriyan, Alexander</dc:creator>
          <dc:creator>Blaschke, David</dc:creator>
          <dc:creator>Pablo Carlomagno, Juan</dc:creator>
          <dc:creator>Contrera, Gustavo A.</dc:creator>
          <dc:creator>Gabriela Grunfeld, Ana</dc:creator>
          <dc:date>2025-07-05</dc:date>
          <dc:description>This dataset contains tabulated hybrid Equations of State (EOS) for neutron star matter, with a phase transition generated by a Maxwell construction between an instantaneous nonlocal chiral quark model for the quark matter phase and the relativistic mean field model "DD2" for the nuclear matter phase. The Bayesian analysis explores the EOS parameter space characterized by the coupling constants \eta_D and \eta_V, which govern diquark and vector interactions, respectively. The provided data includes EOS tables for selected parameter sets. The coupling parameters were selected from the 60% Bayesian credibility region for physically significant cases (see figure Hybrid_EoS_Bayesian_Analysis.png), such as: • the maximum and minimum neutron star masses • the maximum and minimum neutron star onset • the most probable EOS from the Bayesian posterior This dataset enables further analysis of neutron star properties, supporting transparency and reproducibility of the published results.</dc:description>
          <dc:description>The research was supported by the Polish National Science Center (NCN) under the Polonez-BIS program with grant number 2021/43/P/ST2/03319 and by the Argentinian organizations CONICET, ANPCyT and UNLP under grants Numbers PIP 2022-2024 GI-11220210100150CO, PICT19-00792, PICT22-03-00799 and X960, respectively.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3855</dc:identifier>
          <dc:identifier>10.14278/rodare.3855</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3855</dc:identifier>
          <dc:relation>doi:10.3390/universe11050141</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41590</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-41519</dc:relation>
          <dc:relation>doi:10.14278/rodare.3854</dc:relation>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
          <dc:subject>Bayesian analysis</dc:subject>
          <dc:subject>hybrid neutron stars</dc:subject>
          <dc:subject>color superconductivity</dc:subject>
          <dc:subject>quark deconfinement</dc:subject>
          <dc:title>Data publication: Bayesian Analysis of Hybrid Neutron Star EOS Constraints within an Instantaneous Nonlocal Chiral Quark Matter Model</dc:title>
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        <datestamp>2024-08-08T10:33:20Z</datestamp>
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          <dc:creator>Kovalev, Sergey</dc:creator>
          <dc:creator>Hafez, Hassan A.</dc:creator>
          <dc:creator>Tielrooij, Klaas-Jan</dc:creator>
          <dc:creator>Deinert, Jan-Christoph</dc:creator>
          <dc:creator>Ilyakov, Igor</dc:creator>
          <dc:creator>Awari, Nilesh</dc:creator>
          <dc:creator>Alcaraz, David</dc:creator>
          <dc:creator>Soundarapandian, Karuppasamy</dc:creator>
          <dc:creator>Saleta, David</dc:creator>
          <dc:creator>Germanskiy, Semen</dc:creator>
          <dc:creator>Chen, Min</dc:creator>
          <dc:creator>Bawatna, Mohammed</dc:creator>
          <dc:creator>Green, Bertram Windisch</dc:creator>
          <dc:creator>Koppens, Frank H. L.</dc:creator>
          <dc:creator>Mittendorff, Martin</dc:creator>
          <dc:creator>Bonn, Mischa</dc:creator>
          <dc:creator>Gensch, Michael</dc:creator>
          <dc:creator>Turchinovich, Dmitry</dc:creator>
          <dc:date>2021-12-21</dc:date>
          <dc:description>This research data publications contains the sorted pulse-resolved data and metadata corresponding to the linked publication: Electrical tunability of terahertz nonlinearity in graphene.

The final data evaluation and preparation of figures was done externally by Dr. Hassan Hafez, who should be contacted in terms of assigning raw data to data shown in publication.</dc:description>
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          <dc:relation>info:eu-repo/grantAgreement/EC/H2020/654220/</dc:relation>
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          <dc:relation>url:https://www.hzdr.de/publications/Publ-33778</dc:relation>
          <dc:relation>doi:10.1126/SCIADV.ABF9809</dc:relation>
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          <dc:rights>info:eu-repo/semantics/restrictedAccess</dc:rights>
          <dc:subject>Graphene</dc:subject>
          <dc:subject>THz-driven dynamics</dc:subject>
          <dc:subject>Terahertz</dc:subject>
          <dc:subject>Dirac material</dc:subject>
          <dc:subject>Electrical gating</dc:subject>
          <dc:subject>High harmonic generation</dc:subject>
          <dc:subject>Optoelectronics</dc:subject>
          <dc:subject>Ultrafast</dc:subject>
          <dc:title>Research data: Electrical tunability of terahertz nonlinearity in graphene</dc:title>
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        <datestamp>2025-12-15T07:03:11Z</datestamp>
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          <dc:creator>Barnowsky, Tom</dc:creator>
          <dc:creator>Friedrich, Rico</dc:creator>
          <dc:date>2025-12-12</dc:date>
          <dc:description>FINDSLAB: Software for Exfoliation and Cleavage of Crystals

Tom Barnowsky &amp; Rico Friedrich
Technische Universität Dresden &amp; Helmholtz-Zentrum Dresden-Rossendorf, Germany

This program implements the XCP method to identify 2D materials from bulk materials by estimating bonding energies using a two-body potential model [1].

Potential Models

The code supports a range of two-body potential parametrizations \(V(r)\), namely:


	Lennard-Jones + Yukawa
	Morse + Yukawa
	Mie + Yukawa


Parameters are provided as plain text files which are specified via the environment variable `FINDSLAB_POTDATA`. Note that all energies have to be multiplied by a factor two to compare to surface/bonding energies.

Build

Run `make` serially (without `-j n`). A binary will be created in the `bin` directory.

Requirements: a recent Fortran compiler, BLAS and LAPACK.

Usage

FINDSLAB provides some instructions when running `findslab --help`.

The code is designed to work with VASP POSCAR files, however, the reader is not fully general and expects the formatting as it is found in the AFLOW database (aflow.org) [2]. To convert general structure files (including those from other codes) to this format, use the AFLOW software to run `aflow --vasp`. The aflow code is available at github.com/aflow-org/aflow.

Here we provide an example code to determine HKLSEARCH slabs from bulk Ca3N2 retrieved via the AFLOW REST API [3]:

export FINDSLAB_POTDATA=&lt;path to file&gt;
export OPENBLAS_NUM_THREADS=1
curl http://aflowlib.duke.edu/HEX/Ca3N2_ICSD_169727/CONTCAR.relax.vasp |
    aflow --sconv |
    findslab --hklsearch

Conversion to the conventional unit cell via `aflow --sconv` is optional and is only used here to relate Miller indices to the conventional cell.

Acknowledgements

The authors thank Carsten Timm, Steve Schmerler, and Moritz Leucke for fruitful discussions. Parts of this work are based on an implementation for creating Miller planes from the atomic simulation environment (ASE) [4].  Additionally, we implement the criterion of Mounet et al. [5] to identify van der Waals-bound layers in bulk structures.

License

This dataset is published under the Apache 4.0 license. We kindly ask works based on this software to cite this entry and/or the associated publication.</dc:description>
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          <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
          <dc:rights>https://opensource.org/licenses/Apache-2.0</dc:rights>
          <dc:subject>2D materials</dc:subject>
          <dc:subject>non-van der Waals compounds</dc:subject>
          <dc:subject>computational materials science</dc:subject>
          <dc:title>FINDSLAB: Software for Exfoliation and Cleavage of Crystals</dc:title>
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          <dc:type>software</dc:type>
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        <datestamp>2023-02-28T13:31:04Z</datestamp>
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          <dc:contributor>Kraisler, Eli</dc:contributor>
          <dc:contributor>Cangi, Attila</dc:contributor>
          <dc:creator>Callow, Timothy James</dc:creator>
          <dc:date>2022-12-14</dc:date>
          <dc:description>Data for our paper "Improved calculations of mean ionization states with an average-atom model" (arXiv)

 

For details about the data, please see the README file after unpacking the folder, and this GitHub repository.</dc:description>
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          <dc:title>Data publication: Improved calculations of mean ionization states with an average-atom model</dc:title>
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        <datestamp>2025-02-17T11:14:57Z</datestamp>
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          <dc:creator>Kühne, Thomas Dae-Song</dc:creator>
          <dc:date>2024-12-20</dc:date>
          <dc:description>The data contains two archives: One containing all files to calculate the FCIDUMP files in CP2K, and the remaining input and output files of the FCIQMC calculations using NECI, and a second one with all files for DFT and correlated calculations using CP2K.</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/3350</dc:identifier>
          <dc:identifier>10.14278/rodare.3350</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:3350</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-40321</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-40343</dc:relation>
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          <dc:subject>FCIDUMP</dc:subject>
          <dc:subject>correlated methods</dc:subject>
          <dc:subject>CP2K</dc:subject>
          <dc:subject>Full configuration interaction</dc:subject>
          <dc:subject>quantum monte carlo</dc:subject>
          <dc:subject>density functional theory</dc:subject>
          <dc:subject>NECI</dc:subject>
          <dc:title>Data to "Assessment of post-SCF Methods with Localized Basis Sets for Periodic Systems using FCI-QMC"</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
          <dc:type>dataset</dc:type>
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        <datestamp>2024-08-13T12:13:26Z</datestamp>
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          <dc:creator>Jain, Archa</dc:creator>
          <dc:creator>Bayrak, Türkan</dc:creator>
          <dc:creator>Erbe, Artur</dc:creator>
          <dc:date>2021-05-03</dc:date>
          <dc:description>IV-curves measured on self-organized Au nanogaps. HSQ-wires are 10 nm gaps without DNA molecules, to characterise the insulating properties of HSQ resist. Au_nanowire are measurements of continuous Au nanowires. The temperature dependent measurements characterize self-organised Au contacts to DNA ensembles with 10 nm length</dc:description>
          <dc:identifier>https://rodare.hzdr.de/record/968</dc:identifier>
          <dc:identifier>10.14278/rodare.968</dc:identifier>
          <dc:identifier>oai:rodare.hzdr.de:968</dc:identifier>
          <dc:language>eng</dc:language>
          <dc:relation>doi:10.17815/jlsrf-3-159</dc:relation>
          <dc:relation>doi:10.1002/adma.202100381</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-32598</dc:relation>
          <dc:relation>url:https://www.hzdr.de/publications/Publ-32362</dc:relation>
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          <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
          <dc:rights>info:eu-repo/semantics/closedAccess</dc:rights>
          <dc:subject>Nanoelectronics</dc:subject>
          <dc:subject>Self-Organisation</dc:subject>
          <dc:subject>DNA Origami</dc:subject>
          <dc:title>IV-data for Complex Metal Nanostructures with Programmable Shapes from Simple DNA Building Blocks</dc:title>
          <dc:type>info:eu-repo/semantics/other</dc:type>
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          <dc:creator>Marre, Brian Edward</dc:creator>
          <dc:date>2021-10-07</dc:date>
          <dc:description>Master Thesis discussing approaches to including atomic physics in PIC simulations for transient non-thermal plasmas and developing new approaches and algorithms for doing so.</dc:description>
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          <dc:subject>PIC</dc:subject>
          <dc:subject>atomic physics</dc:subject>
          <dc:subject>picongpu</dc:subject>
          <dc:subject>plasma</dc:subject>
          <dc:subject>Particle in Cell</dc:subject>
          <dc:subject>simulation</dc:subject>
          <dc:subject>Markov-Chain rate solver</dc:subject>
          <dc:subject>Monte-Carlo rate solver</dc:subject>
          <dc:title>Coupling of atomic states to particle in cell simulations</dc:title>
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        <datestamp>2025-07-15T08:04:27Z</datestamp>
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by Bruno Neumann, Giovanna Jocobi, Ali Izadi, Andreas Henschke and Sebastian Fähler.</dc:description>
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          <dc:subject>Shape Memory Alloys</dc:subject>
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