{ "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" 4.989170089364052 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.989170089364052e-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" [ 3.45899666481383 3.10634366937511 3.14694481196458 3.15659005174756 3.13459536115316 3.11647524891922 3.07963913231886 3.18469152053776 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.45899666481383e-10 3.10634366937511e-10 3.14694481196458e-10 3.15659005174756e-10 3.13459536115316e-10 3.11647524891922e-10 3.07963913231886e-10 3.18469152053776e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.005063234934782313 0.2826087155484027 0.2782565303046423 0.2765608412164881 0.25655133567184085 0.2532582771724822 0.26207424691172976 0.279221448604005 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.005063234934782313 0.2826087155484027 0.2782565303046423 0.2765608412164881 0.2565513356718409 0.2532582771724822 0.2620742469117298 0.279221448604005 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" ] } "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 ] } }