{ "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" 3.5199998259544394 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.51999982595444e-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" [ 2.46957045516608 2.23777076463009 2.2303938070131 2.25381870863405 2.28199534458606 2.27157559121517 2.28121322880846 2.3654827442823 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46957045516608e-10 2.23777076463009e-10 2.2303938070131e-10 2.25381870863405e-10 2.28199534458606e-10 2.27157559121517e-10 2.28121322880846e-10 2.3654827442823e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02223753114603934 1.363080815933972 1.3681763255074877 1.4033494556850634 1.3415361921321185 1.3416843375930725 1.3412058354139438 1.08627404905892 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02223753114603934 1.363080815933972 1.368176325507488 1.403349455685063 1.341536192132118 1.341684337593072 1.341205835413944 1.08627404905892 ] } "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 ] } }