{ "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" 2.8665000349283223 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866500034928322e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47786004522543 2.33552473668317 2.33516336657739 2.30832798778839 2.32880800374002 2.31463148108553 2.34131518530679 2.33217027340437 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47786004522543e-10 2.33552473668317e-10 2.33516336657739e-10 2.30832798778839e-10 2.32880800374002e-10 2.31463148108553e-10 2.34131518530679e-10 2.33217027340437e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01611069873169636 1.1752428237184647 1.2113115744571872 1.2073335589909515 1.1511755907570047 1.07180556005572 0.935651181141267 0.33708774669367897 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01611069873169636 1.175242823718465 1.211311574457187 1.207333558990952 1.151175590757005 1.07180556005572 0.935651181141267 0.337087746693679 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "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 ] } }