Documents (homepage presently under re-construction)
Publications 2025
Effects of isotope and chemical incoherence on self‐diffusion of atoms in liquid alloys of gallium with isotopes of nickel: Experiments based on quasielastic neutron scattering versus molecular dynamics simulations
I. Goychuk; A. Panchenko; A. Shahzad; J. Steffen; C. Neiss; K. Götz; C. Vogel; M. Weisser; B. Hakim; J. P. Embs; J. Englhard; J. Bachmann; H. Hildebrand; N. Denisov; P. Schmuki; A. Görling; T. Unruh
Phys. Rev. B 111, 064302 (2025)
DOI: https://doi.org/10.1103/PhysRevB.111.064302
RefXAS: an open access database of X‐ray absorption spectra – improvements and outlook
S. Paripsa; A. Gaur; F. Förste; D. E. Doronkin; W. Malzer; C. Schlesiger; B. Kanngiesser; E. Welter; J.-D. Grunwaldt; D. Lützenkirchen-Hecht
Proc. 15th International Conference on Synchrotron Radiation Instrumentation (SRI 2024), J. Phys. Conf. Ser. (2025) – accepted
DOI: https://www.sri2024.eu/proceedings/
Implementation of the quick‐scanning EXAFS technique at DELTA beamline 10
S. Paripsa; L. Voss; F. Braun; F. Eckelt; D. Lützenkirchen-Hecht
Proc. 15th International Conference on Synchrotron Radiation Instrumentation (SRI 2024), J. Phys. Conf. Ser. (2025) – accepted
DOI: https://doi.org/10.3390/cryst13111533
Specifications for Electronic Laboratory Notebooks (ELN) in the Photon and Neutron Community
P. Jordt; M. Osterhoff; Y. Tymoshenko; B. Hakim; P. Dolcet; F. Maurer; V. Biniyaminov; L. Amelung; F. Dall’Antonia; J.-D. Grunwaldt; F. Weber; W. Lohstroh; B. M. Murphy
Synchrotron Radiation News 37, 3–8 (2025)
DOI: https://doi.org/10.1080/08940886.2024.2432265
Specifications for Electronic Laboratory Notebooks (ELN) in the Photon and Neutron Community
P. Jordt; M. Osterhoff; Y. Tymoshenko; B. Hakim; P. Dolcet; F. Maurer; V. Biniyaminov; L. Amelung; F. Dall’Antonia; J.-D. Grunwaldt; F. Weber; W. Lohstroh; B. M. Murphy
Synchrotron Radiation News, pp. 1–6 (2025)
DOI: https://doi.org/10.1080/08940886.2024.2432265
Benchmarking deep learning for automated peak detection on GIWAXS data
C. Völter; V. Starostin; D. Lapkin; V. Munteanu; M. Romodin; M. Hylinski; A. Gerlach; A. Hinderhofer; F. Schreiber
J. Appl. Cryst. (2025), in print
Fast and reliable probabilistic reflectometry inversion with prior‐amortized neural posterior estimation
V. Starostin; M. Dax; A. Gerlach; A. Hinderhofer; Á. Tejero-Cantero; F. Schreiber
Science Adv. (2025), in print
Rendering the european neutron research landscape
E. Velichko; H. Abele; D. J. Barlow; A. Benedetto; S. Deledda; L. van Eijck; M. T. Fernandez-Diaz; M. Janoschek; M. Karlsson; K. Lefmann; N. Malikova; M. P. M. Marques; K. Mergia; J. Pieper; H. M. Rønnow; J. Šaroun; A. Schneidewind; F. Schreiber; K. Temst; M. Wolff; W. Zaj?c; M. Zanatta
Sci. Rep. (2025), in print
FAIR data-the photon and neutron communities move together towards open science
BM Murphy, A Götz, C Gutt, C McGuinness, HM Rønnow, A Schneidewind, U Pietsch
IUCrJ, 12(Pt 1), pp. 8–15
Publications 2024
Nucleation Behavior of SnS₂ on Thiol Functionalized SAMs During Solution-Based Atomic Layer Deposition
K. Götz; A. Prihoda; C. Shen; M. Dierner; J. Dallmann; S. Prusch; D. Zahn; E. Spiecker; T. Unruh
Adv. Mater. Interfaces 11, 2300990 (2024)
DOI: https://doi.org/10.1002/admi.202300990
Highly Ordered Monolayers of ?m-Sized Polystyrene Spheres Studied by Grazing-Incidence Small-Angle X-ray Scattering, Simulations, and Geometrical Calculations
S. Maiti; L. N. Senavirathna; I. Minguez Bacho; J. Menath; W. Gruber; N. Vogel; J. Bachmann; T. Unruh
Langmuir 40, 1185 (2024)
DOI: https://doi.org/10.1021/acs.langmuir.3c02219
Atomic diffusion in liquid gallium and gallium‐nickel alloys probed by quasielastic neutron scattering and molecular dynamic simulations
A. Shahzad; F. Yang; J. Steffen; C. Neiss; A. Panchenko; K. Götz; C. Vogel; M. Weisser; J. P. Embs; W. Petry; W. Lohstroh; A. Görling; I. Goychuk; T. Unruh
J. Phys.: Condens. Matter 36, 175403 (2024)
DOI: https://doi.org/10.1088/1361-648X/ad1e9f
Mesoscopic Structure of Lipid Nanoparticle Formulations for mRNA Drug Delivery: Comirnaty and Drug-Free Dispersions
T. Unruh; K. Götz; C. Vogel; E. Fröhlich; A. Scheurer; L. Porcar; F. Steiniger
ACS Nano 18, 9746 (2024)
DOI: https://doi.org/10.1021/acsnano.4c02610
RefXAS: an open access database of X‐ray absorption spectra
S. Paripsa; A. Gaur; F. Förste; D. E. Doronkin; W. Malzer; C. Schlesiger; B. Kanngiesser; E. Welter; J.-D. Grunwaldt; D. Lützenkirchen-Hecht
J. Synchrotron Rad. 31, 1105–1117 (2024)
DOI: https://doi.org/10.1107/S1600577524006751
Lifecycle of Pd Clusters: Following the Formation and Evolution of Active Pd Clusters on Ceria During CO Oxidation by In Situ/Operando Characterization Techniques
D. Gashnikova; F. Maurer; M. Bauer; S. Bernart; J. Jelic; M. Lützen; C. B. Maliakkal; P. Dolcet; F. Studt; C. Kübel; C. D. Damsgaard; M. Casapu; J.-D. Grunwaldt
ACS Catalysis 14 (19), 14871–14886 (2024)
DOI: https://doi.org/10.1021/acscatal.4c02077
Supported Binuclear Gold Phosphine Complexes as CO Oxidation Catalysts: Insights into the Formation of Surface-Stabilized Au Particles
F. Rang; T. Delrieux; F. Maurer; F. Flecken; J.-D. Grunwaldt; S. Hanf
Small Sci. 4, 2400345 (2024)
DOI: https://doi.org/10.1002/smsc.202400345
Operando Spectroscopy to Understand Dynamic Structural Changes of Solid Catalysts
B. B. Sarma; J.-D. Grunwaldt
Chimia 78, 288 (2024)
DOI: https://doi.org/10.2533/chimia.2024.288
Synergy of Ag and Pd in bimetallic catalysts for the selective oxidation of 5-(hydroxymethyl)furfural
D. Neukum; M. Eyleen Ludwig; G. Uzunidis; A. R. L. Nilayam; B. Krause; S. Behrens; J.-D. Grunwaldt; E. Saraçi
Catal. Sci. Technol. 14, 7163–7171 (2024)
DOI: https://doi.org/10.1039/D4CY01028K
Neural network analysis of neutron and X‐ray reflectivity data incorporating prior knowledge
V. Munteanu; V. Starostin; A. Greco; L. Pithan; A. Gerlach; A. Hinderhofer; S. Kowarik; F. Schreiber
J. Appl. Cryst. 57, 456 (2024)
Resource-aware research on universe and matter: call-to-action in digital transformation
B. Bruers; M. Cruces; M. Demleitner; G. Duckeck; M. Düren; N. Eich; T. Enßli; J. Erdmann; M. Erdmann; P. Fackeldey; C. Felder; B. Fischer; S. Fröse; S. Funk; M. Gasthuber; A. Grimshaw; D. Hadasch; M. Hannemann; A. Kappes; R. Kleinemühl; O. M. Kozlov; T. Kuhr; M. Lupberger; S. Neuhaus; P. Niknejadi; J. Reindl; D. Schindler; A. Schneidewind; F. Schreiber; M. Schumacher; K. Schwarz; A. Streit; R. Florian von Cube; R. Walker; C. Walther; S. Wozniewski; K. Zhou
Eur. Phys. J. Spec. Top. (2024), in print
X‐ray phase‐contrast tomography of cells manipulated with an optical stretcher
Jan-Philipp Burchert; Jasper Frohn; Ulrike Rölleke; Hendrik Bruns; Boram Yu; Sophie-Charlotte Gleber; Roland Stange; Madleen Busse; Markus Osterhoff; Tim Salditt; Sarah Köster
Journal of Synchrotron Radiation 31 (4), 923–935 (2024)
DOI: https://doi.org/10.1107/S1600577524003618
The Snip Advantage: Elevating Research Through Digital Lab Notebooks
M. Osterhoff; S. Mohr; S. Köster
Online Publication (2024)
Synergy of Ag and Pd in bimetallic catalysts for the selective oxidation of 5-(hydroxymethyl)furfural
Dominik Neukum, Maya Eyleen Ludwig, Georgios Uzunidis, Ajai Raj Lakshmi Nilayam, Bärbel Krause, Silke Behrens, Jan-Dierk Grunwaldt and Erisa Saraçi
Catalysis Science and Technology, 14(24), pp. 7163–7171
Lifecycle of Pd Clusters: Following the Formation and Evolution of Active Pd Clusters on Ceria During CO Oxidation by In Situ/Operando Characterization Techniques
Daria Gashnikova, Florian Maurer, Miriam R. Bauer, Sarah Bernart, Jelena Jelic, Mads Lü tzen, Carina B. Maliakkal, Paolo Dolcet, Felix Studt, Christian Kü bel, Christian D. Damsgaard, Maria Casapu,
and Jan-Dierk Grunwaldt
ACS Catalysis, 14(19), pp. 14871–14886
Nucleation Behavior of SnS2 on Thiol Functionalized SAMs During Solution-Based Atomic Layer Deposition
K Götz, A Prihoda, C Shen, M Dierner, J Dallmann, S Prusch, D Zahn, E Spiecker, T Unruh
Journal of Physics Condensed Matter, 36(17), 175403
Computation of X-ray and Neutron Scattering Patterns to Benchmark Atomistic Simulations against Experiments
A Majumdar, M Müller, S Busch
International Journal of Molecular Sciences, 25(3), 1547
Publications 2023
Substituting fossil-based with bio-based chemicals: the case of limonene as a greener pore expander for micellar templated silica
U. Sultan; K. Städtke; A. Göpfert; D. Lemmen; E. Metwali; S. Maiti; C. Schlumberger; T. Yokosawa; B. Apeleo Zubiri; E. Spiecker; N. Vogel; T. Unruh; M. Thommes; A. Inayat
RSC Sustain. 1, 1449 (2023)
DOI: https://doi.org/10.1039/D3SU00068K
EXtra-XWiz: a tool to streamline serial femtosecond crystallography workflows at European XFEL
O. Turkot; F. Dall’Antonia; R. J. Bean; J. E; H. Fangohr; D. E. F. De Lima; S. Kantamneni; H. J. Kirkwood; F. H. M. Koua; A. P. Mancuso; D. V. M. Melo; A. Round; M. Schuh; E. Sobolev; R. De Wijn; J. J. Wrigley; L. Gelisio
Crystals 13(11), 1533 (2023)
Metadata Fields and Quality Criteria – XAS Reference Database under DAPHNE4NFDI
A. Gaur; S. Paripsa; F. Förste; D. E. Doronkin; W. Malzer; C. Schlesiger; B. Kanngießer; E. Welter; J.-D. Grunwaldt; D. Lützenkirchen-Hecht
Conf. on Res. Data Infras. (CoRDI) 1 (2023)
DOI: https://doi.org/10.52825/CoRDI.v1i.258
Closing the loop: Autonomous experiments enabled by machine-learning-based online data analysis in synchrotron beamline environments
L. Pithan; V. Starostin; D. Marecek; L. Petersdorf; C. Völter; V. Munteanu; M. Jankowski; O. Konovalov; A. Gerlach; A. Hinderhofer; B. Murphy; S. Kowarik; F. Schreiber
J. Synchrotron Rad. 30, 1064 (2023)
Machine learning for scattering data: strategies, perspectives, and applications to surface scattering
A. Hinderhofer; A. Greco; V. Starostin; V. Munteanu; L. Pithan; A. Gerlach; F. Schreiber
J. Appl. Cryst. 56, 3 (2023)
Closing the loop: autonomous experiments enabled by machine-learning-based online data analysis in synchrotron beamline environments
Linus Pithan, Vladimir Starostin, David Marecek, Lukas Petersdorf, Constantin Völter, Valentin Munteanu, Maciej Jankowski, Oleg Konovalov, Alexander Gerlach, Alexander Hinderhofer, Bridget Murphy, Stefan Kowarik and Frank Schreiber
Journal of Synchrotron Radiation, 30(Pt 6), pp. 1064–1075
An Advanced Characterization Toolbox for Selective Olefin Oxidation Catalysts
L. Klag, TL Sheppard, J.-D. Grunwaldt
ChemCatChem, 15(3), e202201276
Machine learning for scattering data: strategies, perspectives and applications to surface scattering
A. Hinderhofer, A. Greco, V. Starostin, V. Munteanu, L. Pithan, A. Gerlach, F. Schreiber
Journal of Applied Crystallography, 56, pp. 3–11
DAta from PHoton and Neutron Experiments–DAPHNE4NFDI–Annual Meeting 2023
P Dolcet, JD Grunwaldt, S Hövelmann, L Amelung, A Schneidewind
Synchrotron Radiation News, 36(6), pp. 55–57
Several Partners – Joint Effort: RDM Synergies in Large Scale Research
Schneidewind, A., Schwarz, K., Schörner, T., Murphy, B. M., Erdmann, M.
Proceedings of the Conference on Research Data Infrastructure, 1 (2023)
DOI: https://doi.org/10.52825/cordi.v1i.337
PIDs in the Natural Sciences
Schörner, T., Barty, A., Demleitner, M., Enke, H., Koepler, O., Köhler, M., Stein, L.-M.
Proceedings of the Conference on Research Data Infrastructure, 1. (2023)
DOI: https://doi.org/10.52825/cordi.v1i.361
Publications 2022
End-to-end deep learning pipeline for real-time processing of surface scattering data at synchrotron facilities
V. Starostin; L. Pithan; A. Greco; V. Munteanu; A. Gerlach; A. Hinderhofer; F. Schreiber
Synchrotron Radiation News 35, 21 (2022)
Tracking perovskite crystallization via deep learning-based feature detection on 2D X-ray scattering data
V. Starostin; V. Munteanu; A. Greco; E. Kneschaurek; A. Pleli; F. Bertram; A. Gerlach; A. Hinderhofer; F. Schreiber
npj Comput. Mater. 8, 101 (2022)
Neural network analysis of neutron and X-ray reflectivity data: automated analysis using mlreflect, experimental errors and feature engineering
A. Greco; V. Starostin; E. Edel; V. Munteanu; N. Russegger; I. Dax; C. Shen; F. Bertram; A. Hinderhofer; A. Gerlach; F. Schreiber
J. Appl. Cryst. 55, 362 (2022)
End-to-End Deep Learning Pipeline for Real-Time Processing of Surface Scattering Data at Synchrotron Facilities
V Starostin, L Pithan, A Greco, V Munteanu, A Gerlach, A Hinderhofer, F Schreiber
Synchrotron Radiation News, 35(4), pp. 21–27
Publications - Zenodo
End-to-End Deep Learning Pipeline for Real-Time Processing of Surface Scattering Data at Synchrotron Facilities, Synchrotron Radiation News
Vladimir Starostin, Linus Pithan, Alessandro Greco, Valentin Munteanu, Alexander Gerlach, Alexander Hinderhofer & Frank Schreiber
2022, DOI: 10.1080/08940886.2022.2112499
In-situ grazing-incidence X-ray diffraction data of the crystallization process of organic-inorganic methylammonium lead bromide perovskite (MAPbBr3) via employing an isopropanol antisolvent. Raw Data
Pithan, Linus (Universität Tübingen);Kneschaurek, Ekaterina (Universität Tübingen);Scheffczyk, Niels (Universität Tübingen);Starostion, Vladimir (Universität Tübingen);Munteanu, Valentin (Universität Tübingen);Hinderhofer, Alexander (Universität Tübingen);Scheiber, Frank (Universität Tübingen)
2022, DOI: https://doi.org/10.5281/zenodo.6683617
GIXD data of organic-inorganic methylammonium lead bromide perovskite (MAPbBr3), processed q-space maps
Starostion, Vladimir (Universität Tübingen);Pithan, Linus (Universität Tübingen);Kneschaurek, Ekaterina (Universität Tübingen);Hinderhofer, Alexander (Universität Tübingen);Scheiber, Frank (Universität Tübingen)
2022, DOI: https://doi.org/10.5281/zenodo.6683626
DAPHNE4NFDI
Hannemann, Moritz (Forschungszentrum Jülich GmbH)
2022, DOI: https://doi.org/10.5281/zenodo.7188049
DAPHNE4NFDI. DAta from PHoton and Neutron Experiments
Amelung, Lisa (Deutsches Elektronen-Synchrotron DESY, Hamburg)
2022, DOI: https://doi.org/10.5281/zenodo.7414563
IGSN International Generic Sample Numbers - uniquely identifying your samples
Elger, Kirsten (GFZ German Research Centre for Geosciences);Frenzel, Simone (GFZ German Research Centre for Geosciences);Brauser, Alexander (GFZ German Research Centre for Geosciences)
2022, DOI: https://doi.org/10.5281/zenodo.7370845
DAPHNE4NFDI - Consortium Proposal
Barty, Anton (Deutsches Elektronen-Synchrotron (DESY));Gutt, Christian (Universität Siegen);Lohstroh, Wiebke (Heinz Maier-Leibnitz Zentrum (MLZ), Technische Universität München);Murphy, Bridget (Christian-Albrechts-Universität zu Kiel);Schneidewind, Astrid (Jülich Centre for Neutron Science (JCNS) at Heinz Maier-Leibnitz Zentrum (MLZ), Forschungszentrum Jülich GmbH);Grunwaldt, Jan-Dierk (Karlsruher Institut für Technologie (KIT));Schreiber, Frank (Eberhard Karls Universität Tübingen);Busch, Sebastian (German Engineering Materials Science Centre (GEMS) at Heinz Maier-Leibnitz Zentrum (MLZ), Helmholtz-Zentrum hereon GmbH);Unruh, Tobias (Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU));Bussmann, Michael (Helmholtz-Zentrum Dresden-Rossendorf);Fangohr, Hans (Max-Planck-Institut für Struktur und Dynamik der Materie, European XFEL, University of Southampton);Görzig, Heike (Helmholtz-Zentrum Berlin für Materialien und Energie);Houben, Andreas (RWTH Aachen University);Kluge, Thomas (Helmholtz-Zentrum Dresden-Rossendorf);Manke, Ingo (Helmholtz-Zentrum Berlin für Materialien und Energie);Lützenkirchen-Hecht, Dirk (Bergische Universität Wuppertal);Schneider, Thomas R. (European Molecular Biology Laboratory, Hamburg Unit c/o DESY);Weber, Frank (Karlsruher Institut für Technologie (KIT));Bruno, Giovanni (Bundesanstalt für Materialforschung und -prüfung (BAM));Einsle, Oliver (Albert-Ludwigs-Universität Freiburg);Felder, Christian (Jülich Centre for Neutron Science (JCNS) at Heinz Maier-Leibnitz Zentrum (MLZ), Forschungszentrum Jülich GmbH);Herzig, Eva M. (Universität Bayreuth);Konrad, Uwe (Helmholtz-Zentrum Dresden-Rossendorf);Markötter, Henning (Bundesanstalt für Materialforschung und -prüfung (BAM));Rossnagel, Kai (Deutsches Elektronen-Synchrotron (DESY));Sheppard, Thomas (Karlsruher Institut für Technologie (KIT));Turchinovich, Dmitry (Universität Bielefeld)
2023, DOI: https://doi.org/10.5281/zenodo.8040606
Raw and metadata for: Substituting fossil-based with bio-based chemicals: the case of limonene as a greener pore expander for micellar templated silica
Sultan, Umair (Institute of Chemical Reaction Engineering and Institute of Particle Technology, Department of Chemical and Biological Engineering, Friedrich-Alexander Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany);Städtke, Katrin (Institute of Chemical Reaction Engineering, Department of Chemical and Biological Engineering, Friedrich-Alexander Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany);Göpfert, Andreas (Institute of Chemical Reaction Engineering, Department of Chemical and Biological Engineering, Friedrich-Alexander Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany);Lemmen, Daniel (Institute of Chemical Reaction Engineering, Department of Chemical and Biological Engineering, Friedrich-Alexander Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany);Metwali, Ezzeldin (Institute for Crystallography and Structural Physics (ICSP), Department of Physics, Friedrich-Alexander Universität Erlangen-Nürnberg, Staudtstrasse 3, Erlangen 91058, Germany);Maiti, Santanu (Institute for Crystallography and Structural Physics (ICSP), Department of Physics, Friedrich-Alexander Universität Erlangen-Nürnberg, Staudtstrasse 3, Erlangen, Germany);Schlumberger, Carola (Institute of Separation Science and Technology, Department of Chemical and Biological Engineering, Friedrich-Alexander-Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany);Yokosawa, Tadahiro (Institute of Micro- and Nanostructure Research (IMN), Center for Nanoanalysis and Electron Microscopy (CENEM), IZNF, Friedrich-Alexander-Universität Erlangen-Nürnberg, IZNF, Cauerstrasse 3, 91058 Erlangen, Germany);Apeleo Zubiri, Banjamin (Institute of Micro- and Nanostructure Research (IMN), Center for Nanoanalysis and Electron Microscopy (CENEM), IZNF, Friedrich-Alexander-Universität Erlangen-Nürnberg, IZNF, Cauerstrasse 3, 91058 Erlangen, Germany);Spiecker, Erdmann (Institute of Micro- and Nanostructure Research (IMN), Center for Nanoanalysis and Electron Microscopy (CENEM), IZNF, Friedrich-Alexander-Universität Erlangen-Nürnberg, IZNF, Cauerstrasse 3, 91058 Erlangen, Germany);Vogel, Nicolas (Institute of Particle Technology, Department of Chemical and Biological Engineering, Friedrich-Alexander-Universität Erlangen-Nürnberg, Cauerstrasse 4, 91058 Erlangen, Germany);Unruh, Tobias (Institute for Crystallography and Structural Physics (ICSP), Department of Physics, Friedrich-Alexander Universität Erlangen-Nürnberg, Staudtstrasse 3, Erlangen 91058, Germany);Thommes, Matthias (Institute of Separation Science and Technology, Department of Chemical and Biological Engineering, Friedrich-Alexander-Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany);Inayat, Alexandra (Institute of Chemical Reaction Engineering, Department of Chemical and Biological Engineering, Friedrich-Alexander Universität Erlangen-Nürnberg, Egerlandstrasse 3, 91058 Erlangen, Germany)
2023, DOI: https://doi.org/10.5281/zenodo.8158745
Overarching Data Management Ecosystem at HZDR
Knodel, Oliver (Helmholtz-Zentrum Dresden-Rossendor);Gruber, Thomas (Helmholtz-Zentrum Dresden-Rossendor);Kelling, Jeffrey (Helmholtz-Zentrum Dresden-Rossendor);Lokamani, Mani (Helmholtz-Zentrum Dresden-Rossendor);Müller, Stefan (Helmholtz-Zentrum Dresden-Rossendor);Pape, David (Helmholtz-Zentrum Dresden-Rossendor);Voigt, Martin (Helmholtz-Zentrum Dresden-Rossendor);Juckeland, Guido (Helmholtz-Zentrum Dresden-Rossendor)
2023, DOI: https://doi.org/10.5281/zenodo.8355169
DAPHNE4NFDI: metadata for photon and neutron users at German facilities
Murphy, Bridget (Christian-Albrechts-Universität zu Kiel);Weber, Frank (Karlsruher Institut für Technologie);Lohstroh, Wiebke (Technische Universität München)
2023, DOI: https://doi.org/10.5281/zenodo.8407630
Metadata Fields and Quality Criteria - XAS Reference Database under DAPHNE4NFDI
Gaur, Abhijeet (ITCP, Karlsruhe Institute of Technology);Paripsa, Sebastian (Fk. 4, Physik, Bergische Universität Wuppertal);Förste, Frank (Technische Universität Berlin);Doronkin, Dmitry (ITCP, Karlsruhe Institute of Technology);Malzer, Wolfgang (Technische Universität Berlin);Schlesiger, Christopher (Technische Universität Berlin);Grunwaldt, Jan-Dierk (ITCP, KIT, Karlsruhe (Germany));Kanngießer, Birgit (Technische Universität Berlin);Lützenkirchen-Hecht, Dirk (Fk. 4, Physik, Bergische Universität Wuppertal);Welter, Edmund (Deutsches Elektronen-Synchrotron (DESY),)
2023, DOI: https://doi.org/10.5281/zenodo.8412918
Research Data Management and Data Flow in ROCK-IT – Demonstrator for Automation and Remote-Access to Synchrotron Beamlines
Wiedmann, Christina (Karlsruhe Institute of Technology);Gethmann, Julian (Karlsruhe Institute of Technology)
2023, DOI: https://doi.org/10.5281/zenodo.10064021
SECoP and SECoP@HMC Metadata in the Sample Environment Communication Protocol
Kiefer, Klaus (Helmholtz-Zentrum Berlin für Materialien und Energie)
2024, DOI: https://doi.org/10.5281/zenodo.10925736
XAS reference database under DAPHNE4NFDI
Gaur, Abhijeet (Karlsruher Institut für Technologie)
2024, DOI: https://doi.org/10.5281/zenodo.10940229
RefXAS: XAS reference database under DAPHNE4NFDI
Gaur, Abhijeet (Karlsruher Institut für Technologie)
2024, DOI: https://doi.org/10.5281/zenodo.10948333
From data acquisition to open data repositories - 2024 ESRF practices
DUYME, Renaud (European Synchrotron Radiation Facility);Gotz, Andrew (European Synchrotron Radiation Facility)
2024, DOI: https://doi.org/10.5281/zenodo.11068107
Using the Galaxy Platform in Large Scale Experiments
Liborio, Leandro (Science and Technology Facilities Council);Muon Spectroscopy Computational Project (Science and Technology Facilities Council);Gonzalez-Beltran, Alejandra (Science and Technology Facilities Council);Austin, Patrick (Science and Technology Facilities Council);Devadasan, Subindev (Science and Technology Facilities Council);Nieva de la Hidalga, Abraham (UK Catalysis Hub)
2024, DOI: https://doi.org/10.5281/zenodo.11474732
DAPHNE4NFDI - Draft recommendations on metadata capture and specifications
Lohstroh, Wiebke (Technical University of Munich);Weber, Frank (Karlsruher Institut für Technologie);Busch, Sebastian (Helmholtz-Zentrum Hereon);Görzig, Heike (Helmholtz-Zentrum Berlin für Materialien und Energie);Murphy, Bridget (Kiel University);Coan, Paola (Ludwig-Maximilians-Universität München);Fahad, Hafiz (Ludwig-Maximilians-Universität München);Osterhoff, Markus (University of Göttingen);Tymoshenko, Yuliia (Karlsruher Institut für Technologie);Paripsa, Sebastian (University of Wuppertal);Schneidewind, Astrid (Forschungszentrum Jülich);Herb, Christoph (Technical University of Munich)
2024, DOI: https://doi.org/10.5281/zenodo.12169110
Introduction to PIDs at HZB
Krahl, Rolf (Helmholtz-Zentrum Berlin für Materialien und Energie)
2024, DOI: https://doi.org/10.5281/zenodo.12800186
ML-enabled closed-loop experiments in X-ray reflectometry
Pithan, Linus (Deutsches Elektronen-Synchrotron DESY);Starostin, Vladimir (University of Tübingen)
2024, DOI: https://doi.org/10.5281/zenodo.13309987
RefXAS: XAS Reference Database under DAPHNE4NFDI
Paripsa, Sebastian (University of Wuppertal);Gaur, Abhijeet (Karlsruher Institut für Technologie);Förste, Frank (Technische Universität Berlin);Doronkin, Dmitry (Karlsruher Institut für Technologie);Malzer, Wolfgang (Technische Universität Berlin);Schlesiger, Christopher (Technische Universität Berlin);Kanngießer, Birgit (Technische Universität Berlin);Grunwaldt, Jan-Dierk (Karlsruhe Institute for Technology);Lützenkirchen-Hecht, Dirk (Bergische Universität Wuppertal);Welter, Edmund (Deutsches Elektronen-Synchrotron DESY)
2024, DOI: https://doi.org/10.5281/zenodo.13769740
SciCat: A metadata catalogue for research infrastructures
Pithan, Linus (Deutsches Elektronen-Synchrotron DESY);Novelli, Massimiliano (European Spallation Source)
2024, DOI: https://doi.org/10.5281/zenodo.13683531
DAPHNE4NFDI - Improving Research data management at Synchrotron Facilities
Amelung, Lisa (Deutsches Elektronen-Synchrotron DESY);Barty, Anton (Deutsches Elektronen-Synchrotron DESY);Murphy, Bridget Mary (Kiel University);Grunwaldt, Jan-Dierk (Karlsruher Institut für Technologie);Schneidewind, Astrid (Heinz Maier-Leibnitz Zentrum);Busch, Sebastian (Heinz Maier-Leibnitz Zentrum);Gutt, Christian (University of Siegen);Lohstroh, Wiebke (Heinz Maier-Leibnitz Zentrum);Schreiber, Frank (Eberhard Karls Universität Tübingen);Unruh, Tobias (Friedrich-Alexander-Universität Erlangen-Nürnberg)
2024, DOI: https://doi.org/10.5281/zenodo.13638031
DAPHNE4NFDI - Improving Research data management at Neutron Facilities
Lohstroh, Wiebke (Heinz Maier-Leibnitz Zentrum);Amelung, Lisa (Deutsches Elektronen-Synchrotron DESY);Barty, Anton (Deutsches Elektronen-Synchrotron DESY);Busch, Sebastian (Heinz Maier-Leibnitz Zentrum);Grunwaldt, Jan-Dierk (Karlsruher Institut für Technologie);Gutt, Christian (University of Siegen);Murphy, Bridget (Kiel University);Schneidewind, Astrid (Heinz Maier-Leibnitz Zentrum);Schreiber, Frank (University of Tübingen);Unruh, Tobias (Friedrich-Alexander-Universität Erlangen-Nürnberg)
2024, DOI: https://doi.org/10.5281/zenodo.14012632
Project Information