{ "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" 3.640646010637284 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.640646010637284e-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" [ 2.55082426614613 2.17869226556432 2.22698276664229 2.18992131824318 2.30567697885972 2.05628979850273 2.1265648956406 2.17120758956577 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.55082426614613e-10 2.17869226556432e-10 2.22698276664229e-10 2.18992131824318e-10 2.30567697885972e-10 2.05628979850273e-10 2.1265648956406e-10 2.17120758956577e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015259526892097476 1.0071481291185034 1.003345960822469 1.0431342906784158 0.9798695875560477 0.9677641050230285 0.9556131442401987 0.9979040533817838 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01525952689209748 1.007148129118503 1.003345960822469 1.043134290678416 0.9798695875560477 0.9677641050230285 0.9556131442401987 0.9979040533817838 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }