{"qid": "R06d", "attribution": {"qid": "A10", "contact": {"qid": "C7", "name": "Christophe DOMAIN", "institution": {"qid": "I6", "name": "EDF R&D Lab Les Renardi\u00e8res", "country": "France"}, "email": "christophe.domain@edf.fr"}, "source_doi": "10.1088/1361-648X/aadb4e", "source_url": "https://iopscience.iop.org/article/10.1088/1361-648X/aadb4e", "acknowledgements": "This work has been carried out within the framework of the EUROfusion Consortium and has received funding from the Euratom research and training programme 2014-2018 and 2019-2020 under grant agreement No 633053.\r\nThis work is part of the European project SOTERIA (661913).\r\nThe views and opinions expressed herein do not necessarily reflect those of the European Commission."}, "material": {"chemical-formula": "Fe", "structure": "bcc", "lattice-parameters": {"a": 2.8553, "b": 2.8553, "c": 2.8553, "alpha": 90.0, "beta": 90.0, "gamma": 90.0}}, "potential": {"filename": "fe_mendelev10.pot", "source-doi": "10.1088/0953-8984/16/27/003", "uri": "https://cascadesdb.org/potential/7"}, "has-surface": false, "initially-perfect": true, "PKA-atomic-number": 26, "PKA-energy": 80.0, "recoil": true, "electronic-stopping": false, "thermostat": false, "thermostat-comment": "NVE", "simulation-time": 56.425, "initial-temperature": 100.0, "simulation-box": {"box-X-length": 342.636, "box-Y-length": 342.636, "box-Z-length": 342.636, "box-X-orientation": "100", "box-Y-orientation": "010", "box-Z-orientation": "001"}, "code": {"name": "DYMOKA", "version": "16.10"}, "archive-name": "06d-fe_AM04_100k_bx120_80kev_test1_rnd_80kev100k.tar.gz", "archive_filesize": 295475689, "number-of-simulations": 11, "comments": "PKA direction 1 3 5\r\nthermalization initial conditions: 100 101 102 105 108 109 112 114 115 116 117"}