{ "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" 3.917386054992676 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.917386054992676e-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" [ 2.74471133452484 2.43556470833936 2.4679317637944 2.42454993477473 2.4692187513333 2.47323932634802 2.40582208251682 2.47641834090944 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.74471133452484e-10 2.43556470833936e-10 2.4679317637944e-10 2.42454993477473e-10 2.4692187513333e-10 2.47323932634802e-10 2.405822082516821e-10 2.47641834090944e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02321184884068407 1.3482481767565597 1.3109921514902638 1.429690824365457 1.2104645400953487 1.358048288179715 1.4297119202733561 1.3193660623043377 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02321184884068407 1.34824817675656 1.310992151490264 1.429690824365457 1.210464540095349 1.358048288179715 1.429711920273356 1.319366062304338 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Pt" "Pt" "Pt" "Pt" ] } "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 ] } }