{ "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" 3.518121123313904 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.518121123313904e-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" [ 2.46660247163619 2.16361908661443 2.17116662111766 2.15982558265698 2.17143781007063 2.13818418195278 2.14431245702249 2.18093527800428 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46660247163619e-10 2.16361908661443e-10 2.17116662111766e-10 2.15982558265698e-10 2.17143781007063e-10 2.13818418195278e-10 2.14431245702249e-10 2.18093527800428e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02187237076324878 1.3835536304285856 1.4021090995900594 1.4153744645389585 1.3807532592233387 1.3741730365457805 1.38177615239499 1.3961764473608087 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02187237076324878 1.383553630428586 1.402109099590059 1.415374464538959 1.380753259223339 1.37417303654578 1.38177615239499 1.396176447360809 ] } "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 ] } }