{ "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" 4.044527357816695 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.044527357816695e-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" [ 2.83564005395073 2.55946235817888 2.54714318606739 2.51645156126251 2.62084543513146 2.59918932029098 2.52817493041118 2.68165559942739 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83564005395073e-10 2.55946235817888e-10 2.54714318606739e-10 2.51645156126251e-10 2.62084543513146e-10 2.59918932029098e-10 2.52817493041118e-10 2.68165559942739e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012527698197104052 0.4948479440404516 0.5032249209068328 0.49463479455706516 0.4597444825419451 0.4547372850193521 0.4935360993106097 0.4146235985288359 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01252769819710405 0.4948479440404516 0.5032249209068328 0.4946347945570652 0.4597444825419451 0.4547372850193521 0.4935360993106097 0.4146235985288359 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }