{ "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" 2.863657340407371 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863657340407371e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47609455338265 2.31280537179313 2.31295265570625 2.23803051724742 2.28167469497425 2.32436923596891 2.29787911999421 2.3013816060852 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47609455338265e-10 2.31280537179313e-10 2.31295265570625e-10 2.23803051724742e-10 2.28167469497425e-10 2.32436923596891e-10 2.29787911999421e-10 2.3013816060852e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01618052093597903 1.1511565547855547 1.1883264534949802 1.1869524031193486 1.1245114260468487 1.0070742349767878 0.8954975915157766 0.3251661358220398 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01618052093597903 1.151156554785555 1.18832645349498 1.186952403119349 1.124511426046849 1.007074234976788 0.8954975915157766 0.3251661358220398 ] } "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 ] } }