{ "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" 3.5162327885627747 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.516232788562775e-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" [ 2.46720540346804 2.22134301940674 2.25739252316118 2.22262557424224 2.23469619043107 2.25315395952217 2.22815215449432 2.3289453447827 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46720540346804e-10 2.22134301940674e-10 2.25739252316118e-10 2.22262557424224e-10 2.23469619043107e-10 2.25315395952217e-10 2.22815215449432e-10 2.3289453447827e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.024413354649611613 1.4830150615711037 1.5057715199940398 1.5375891285005827 1.4521927407016804 1.4243210610325057 1.422627266619938 1.270614949322244 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02441335464961161 1.483015061571104 1.50577151999404 1.537589128500583 1.45219274070168 1.424321061032506 1.422627266619938 1.270614949322244 ] } "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 ] } }