{ "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" 3.5224674642086033 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522467464208604e-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" [ 2.47135436067052 2.30113701926131 2.30921438707882 2.28005306317188 2.35796900483119 2.30620727620164 2.25004809531301 2.33492150432933 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47135436067052e-10 2.30113701926131e-10 2.30921438707882e-10 2.28005306317188e-10 2.35796900483119e-10 2.30620727620164e-10 2.25004809531301e-10 2.33492150432933e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022132608231087876 1.280072025297535 1.3050745770216758 1.3079962748135794 1.2399282846609043 1.2216587558331506 1.277368128102477 1.3491367008350177 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02213260823108788 1.280072025297535 1.305074577021676 1.307996274813579 1.239928284660904 1.221658755833151 1.277368128102477 1.349136700835018 ] } "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 ] } }