{ "property-id" "tag:brunnels@noreply.openkim.org,2016-02-18:property/grain-boundary-symmetric-tilt-energy-relaxed-relation-cubic-crystal" "instance-id" 1 "a" { "source-value" 3.5224674642086033 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522467464208604e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "minimum-atom-separation" { "source-value" [ 2.47291724585125 2.28412629657831 2.28034783214197 2.29657532154229 2.33040115447753 2.31424357497789 2.26548567090762 2.37626562122309 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47291724585125e-10 2.28412629657831e-10 2.28034783214197e-10 2.29657532154229e-10 2.33040115447753e-10 2.31424357497789e-10 2.26548567090762e-10 2.37626562122309e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022201494165391963 1.2831057712271658 1.3022383746101345 1.3099032613048134 1.258689901886817 1.2179068919673552 1.2677354098777112 1.0998858466536394 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02220149416539196 1.283105771227166 1.302238374610134 1.309903261304813 1.258689901886817 1.217906891967355 1.267735409877711 1.099885846653639 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "tilt-angle" { "source-value" [ 0.0 24.43269767945453 27.79577249602797 32.20422750397202 38.21321070173819 46.82644889274107 52.659006983369785 59.99999999999999 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4264310196508597 0.4851277481909706 0.562069803005627 0.6669463445036643 0.8172757101951847 0.9190730526904897 1.047197551196598 ] } "tilt-axis" { "source-value" [ 1 1 1 ] } }