Datasæt
- 17 resultater
Søgeresultater
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Replication Data for: Exact two-component Hamiltonians for relativistic quantum chemistry: Two-electron picture-change corrections made simple
Knecht, S. (Ophavsmand), Repisky, M. (Ophavsmand), Jensen, H. J. A. (Ophavsmand) & Saue, T. (Ophavsmand), Zenodo, 6. apr. 2022
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Dataset for the tutorial: "Response properties of embedded molecules through the polarizable embedding model"
Steinmann, C. (Ophavsmand), Reinholdt, P. (Ophavsmand), Nørby, M. S. (Ophavsmand), Kongsted, J. (Ophavsmand) & Olsen, J. M. H. (Ophavsmand), Zenodo, 6. apr. 2018
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Data from: Accelerated redevelopment of vocal skills is preceded by lasting reorganization of the song motor circuitry
Vellema, M. (Ophavsmand), Diales Rocha, M. (Ophavsmand), Bascones, S. (Ophavsmand), Zsebok, S. (Ophavsmand), Dreier, J. (Ophavsmand), Leitner, S. (Ophavsmand), Van der Linden, A. (Ophavsmand), Brewer, J. (Ophavsmand) & Gahr, M. (Ophavsmand), Dryad Digital Repository, 23. maj 2019
DOI: 10.5061/dryad.kb814nh, https://zenodo.org/record/5005724
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MD simulation trajectory and related files for POPC bilayer with 30 mol% of deprotonated pazePC (Berger, Gromacs 4.5.)
Ollila, S. (Ophavsmand) & Khandelia, H. (Ophavsmand), Zenodo, 12. jan. 2016
DOI: 10.5281/zenodo.44622
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Optical data for Cu2O, CuO and Cu in the 1 eV to ~ 100 eV energy range
Tahir, D. (Ophavsmand) & Tougaard, S. M. (Ophavsmand), Zenodo, 23. feb. 2023
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MC--srDFT spin-spin coupling constants input files for Dalton
Kjellgren, E. (Ophavsmand), Zenodo, 4. jun. 2021
DOI: 10.5281/zenodo.4899982, https://zenodo.org/record/4899982
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ELF dielectric functions for various materials.
Yubero, F. (Ophavsmand), Pauly, N. (Ophavsmand) & Tougaard, S. (Bidrager), Zenodo, 9. feb. 2022
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Input files for "Faster Simulations with a 5 fs Time Step for Lipids in the CHARMM Force Field"
Olesen, K. (Ophavsmand) & Khandelia, H. (Ophavsmand), Zenodo, 31. maj 2018
DOI: 10.5281/zenodo.1240161, https://zenodo.org/record/1240161
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Dataset: Implementation of relativistic coupled cluster theory for massively parallel GPU-accelerated computing architectures
Pototschnig, J. V. (Ophavsmand), Papadopoulos, A. (Ophavsmand), Lyakh, D. I. (Ophavsmand), Repisky, M. (Ophavsmand), Halbert, L. (Ophavsmand), Gomes, A. S. P. (Ophavsmand), Jensen, H. J. A. (Ophavsmand) & Visscher, L. (Ophavsmand), Zenodo, 9. mar. 2021
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MM-MD and QM/MM-MD trajectories of para-nitrophenolate derivatives in aqueous solution
Kjellgren, E. (Ophavsmand), Zenodo, 7. nov. 2017
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Equilibrated Kremer-Grest polymer melts of M=500 linear chains with Z=100 entanglements for varying chain stiffness
Carsten, S. (Ophavsmand) & Everaers, R. (Ophavsmand), Zenodo, 1. feb. 2023
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Data files for Constraints on axionlike particles from a combined analysis of three flaring Fermi flat-spectrum radio quasars
Davies, J. (Ophavsmand), Meyer, M. (Ophavsmand) & Cotter, G. (Ophavsmand), Zenodo, 26. jan. 2023
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Calcium Affects Polyphosphate and Lipid Accumulation in Mucoromycota Fungi. Dataset
Dzurendova, S. (Ophavsmand), Zimmermann, B. (Ophavsmand), Kohler, A. (Ophavsmand), Reitzel, K. (Ophavsmand), Gro Nielsen, U. (Ophavsmand), Dupuy--Gallet, B. X. (Ophavsmand), Leivers, S. (Ophavsmand), Horn, S. J. (Ophavsmand) & Shapaval, V. (Ophavsmand), Zenodo, 17. mar. 2022
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Data and supplementary materials in support of "Development and Preliminary Validation of an Open Access, Open Data and Open Outreach Indicator"
Vlachos, E. (Ophavsmand), Ejstrup, R. (Ophavsmand), Drachen, T. M. (Ophavsmand) & Dorch, B. F. (Ophavsmand), Zenodo, 22. jun. 2023
DOI: 10.5281/zenodo.8082868, https://doi.org/10.5281/zenodo.8082868
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Embedding potentials of aqueous acrolein
Hršak, D. (Ophavsmand), Olsen, J. M. H. (Ophavsmand) & Kongsted, J. (Ophavsmand), Zenodo, 16. jan. 2018
DOI: 10.5281/zenodo.1149061, https://zenodo.org/record/1149061
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Controlled multi-photon subtraction with cascaded Rydberg superatoms as single-photon absorbers
Stiesdal, N. (Ophavsmand), Busche, H. (Ophavsmand), Kleinbeck, K. (Ophavsmand), Kumlin, J. (Ophavsmand), Hansen, M. G. (Ophavsmand), Büchler, H. P. (Ophavsmand) & Hofferberth, S. (Ophavsmand), Zenodo, 18. jun. 2021
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Equilibrated Kremer-Grest polymer melts of M=1000 linear chains with Z=200 entanglements for varying chain stiffness
Svaneborg, C. (Ophavsmand) & Eveaers, R. (Ophavsmand), Zenodo, 1. feb. 2023
Datasæt