{ "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" 4.051526293158533 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.051526293158533e-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" [ 2.8403246035108 2.60271171547731 2.60023121957645 2.56877645710626 2.67365300676596 2.63888166244553 2.55358635066228 2.61913734313736 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.8403246035108e-10 2.60271171547731e-10 2.60023121957645e-10 2.56877645710626e-10 2.67365300676596e-10 2.63888166244553e-10 2.55358635066228e-10 2.61913734313736e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012643890940066242 0.7994902165035768 0.8060437106908422 0.8312983870269216 0.7954130452070167 0.7976663282229871 0.8153077254997397 0.8909428159950311 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01264389094006624 0.7994902165035768 0.8060437106908422 0.8312983870269216 0.7954130452070167 0.7976663282229871 0.8153077254997397 0.8909428159950311 ] } "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 ] } }