{ "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" 3.519999980926514 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519999980926514e-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" [ 2.46578971392494 2.17629357239482 2.19219205400255 2.17113145829441 2.20164505014849 2.11571395326374 2.14509972742056 2.13453182167649 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46578971392494e-10 2.17629357239482e-10 2.19219205400255e-10 2.17113145829441e-10 2.20164505014849e-10 2.11571395326374e-10 2.14509972742056e-10 2.13453182167649e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022172651656616013 1.4042971937417048 1.3892932624914922 1.4457226743037714 1.3664251882786929 1.3699728317853275 1.3491576220963668 1.38394546453857 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02217265165661601 1.404297193741705 1.389293262491492 1.445722674303771 1.366425188278693 1.369972831785327 1.349157622096367 1.38394546453857 ] } "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 ] } }