{"qid": "R071", "attribution": {"qid": "A12", "contact": {"qid": "C2", "name": "Andrea SAND", "institution": {"qid": "I2", "name": "Department of Physics, University of Helsinki", "country": "Finland"}, "email": "andrea.sand@helsinki.fi"}, "source_doi": "10.1016/j.jnucmat.2014.09.029", "source_url": "https://www.sciencedirect.com/science/article/pii/S0022311514006199", "acknowledgements": "This work has in part been carried out within the framework of the EUROfusion Consortium and has received funding from the Euratom research and training programme 2014\u20132018 under grant agreement No 633053. Grants from the Academy of Finland and for computer time from the Centre for Scientific Computing in Espoo, Finland, are gratefully acknowledged. The views and opinions expressed herein do not necessarily reflect those of the European Commission."}, "material": {"chemical-formula": "Pt", "structure": "fcc", "lattice-parameters": {"a": 3.92047, "b": 3.92047, "c": 3.92047, "alpha": 90.0, "beta": 90.0, "gamma": 90.0}}, "potential": {"comment": "Pd, Pt; Modified EAM potential; see Nordlund et al., \"Defect production in collision cascades in elemental semiconductors and fcc metals\", Physical Review B 57, 7556 (1998); doi:10.1103/PhysRevB.57.7556", "source-doi": "10.1103/PhysRevB.32.3409", "uri": "http://18.224.66.105/potential/9"}, "has-surface": false, "initially-perfect": true, "PKA-atomic-number": 78, "PKA-energy": 0.07, "recoil": true, "electronic-stopping": true, "electronic-stopping-comment": "for all atoms with K.E. > 10 eV; see publication", "thermostat": true, "thermostat-comment": "on borders, 0 Kelvin; see publication", "simulation-time": 40.0, "initial-temperature": 0.0, "simulation-box": {"box-X-length": 58.80705, "box-Y-length": 58.80705, "box-Z-length": 58.80705, "box-X-orientation": "100", "box-Y-orientation": "010", "box-Z-orientation": "001"}, "code": {"name": "PARCAS", "version": "5.02b"}, "archive-name": "071-pt-0.07.tar.gz", "archive_filesize": 3005504, "number-of-simulations": 20}