{ "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" 2.459976688027382 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.459976688027382e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.1043520330381 2.01341861547232 1.94228514489843 1.96075393334997 1.95341226197233 2.01127634749081 2.004674081587 2.09290147535445 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.1043520330381e-10 2.01341861547232e-10 1.94228514489843e-10 1.96075393334997e-10 1.95341226197233e-10 2.01127634749081e-10 2.004674081587e-10 2.09290147535445e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ -0.1615044578968795 -5.140096382377462 -3.2243307442102287 -1.5696011902907188 -2.573047787717311 -1.4895649882794817 -5.413076502802798 -2.1792513148904904 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ -0.1615044578968795 -5.140096382377462 -3.224330744210229 -1.569601190290719 -2.573047787717311 -1.489564988279482 -5.413076502802798 -2.17925131489049 ] } "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 ] } }