{ "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" 2.8664999604225163 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866499960422516e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47753498354933 2.31346764523467 2.32247674881789 2.28718541711325 2.30216454980356 2.32377047370937 2.23389261463616 2.32694030196423 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47753498354933e-10 2.31346764523467e-10 2.32247674881789e-10 2.28718541711325e-10 2.30216454980356e-10 2.32377047370937e-10 2.23389261463616e-10 2.32694030196423e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016248661169123428 1.3697811707802958 1.4140740715531637 1.4041791360432492 1.3622226580992554 1.206683684371625 1.0560075158027822 0.3885044477370621 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01624866116912343 1.369781170780296 1.414074071553164 1.404179136043249 1.362222658099255 1.206683684371625 1.056007515802782 0.3885044477370621 ] } "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 ] } }