Data publication: Examining different regimes of ionization-induced damage in GaN through atomistic simulations

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true 3.1 HZDR.RODARE 10.14278/rodare.1991 Sequeira, Miguel 0000-0002-0389-6143 Djurabekova, Flyura Department of Physics, University of Helsinki, Helsinki, Finland Nordlund, Kai Department of Physics, University of Helsinki, Helsinki, Finland Mattei, Jean-Gabriel CIMAP, Normandie University, CEA, CNRS, UNICAEN, ENSICAEN-BP5133, Caen Cedex 5, France Monnet, Isabelle CIMAP, Normandie University, CEA, CNRS, UNICAEN, ENSICAEN-BP5133, Caen Cedex 5, France Grygiel, Clara CIMAP, Normandie University, CEA, CNRS, UNICAEN, ENSICAEN-BP5133, Caen Cedex 5, France Alves, Eduardo IPFN, Instituto Superior Técnico, Campus Tecnológico e Nuclear, Lisbon, Portugal Lorenz, Katharina INESC MN, Rua Alves Redol 9, 1000-029 Lisbon, Portugal Data publication: Examining different regimes of ionization-induced damage in GaN through atomistic simulations Rodare 2022 Defects GaN Molecular Dynamics Radiation Recrystallization Two-Temperature Model 2022-12-02 https://rodare.hzdr.de/record/1991 10.1002/smll.202102235 https://www.hzdr.de/publications/Publ-35645 https://www.hzdr.de/publications/Publ-35270 10.14278/rodare.1990 https://rodare.hzdr.de/communities/fwi https://rodare.hzdr.de/communities/rodare Creative Commons Attribution 4.0 International Open Access Two Temperature Model - Molecular Dynamics (TTM-MD) simulations describing the interaction of Swift Heavy Ions (0.35-0.54 MeV/amu Xe, 0.6 and 5.8 MeV/amu Pb, and 3.8 MeV/amu U ions. The simulations are discussed in: Sequeira, M. C., Djurabekova, F., Nordlund, K., Mattei, J.-G., Monnet, I., Grygiel, C., Alves, E., Lorenz, K., Examining Different Regimes of Ionization-Induced Damage in GaN Through Atomistic Simulations. Small 2022, 2102235. <a href="http://doi.org/10.1002/smll.202102235">https://doi.org/10.1002/smll.202102235</a> Each zip file contains the input and output corresponding to each ion simulation. The input and output files are those used and generated by PARCAS 5.22 (https://gitlab.com/acclab/parcas). The radial energy profile deposited by the ion, as calculated within the TTM, can be found in the in/track.in file. The file contains two columns: one with the distance to the ion trajectory (in Angstrom) and another with the energy per atom (in eV/atom). For additional information on the simulations (e.g. bulk vs surface), please refer to the methods section of the reference above.