{ "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" 3.140962809324265 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.140962809324265e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.67469636656616 2.56070921429615 2.53905874740516 2.45647757074493 2.46901282956346 2.54501909996654 2.56576114022536 2.61964313307376 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.67469636656616e-10 2.56070921429615e-10 2.53905874740516e-10 2.45647757074493e-10 2.46901282956346e-10 2.54501909996654e-10 2.56576114022536e-10 2.61964313307376e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ -1.1221873249439474 -2.694607277151265 -1.1910057542701986 -1.512672563306271 -1.160487832106091 -1.4100310173261887 -2.8983152831900107 -1.8513398169910147 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ -1.122187324943947 -2.694607277151265 -1.191005754270199 -1.512672563306271 -1.160487832106091 -1.410031017326189 -2.898315283190011 -1.851339816991015 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Mo" "Mo" "Mo" "Mo" ] } "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 ] } }