{ "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" 2.850997865200043 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.850997865200043e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.43994524392779 2.30366918691731 2.28330782764802 2.30117259881694 2.28739512836942 2.30066405264939 2.30513150331364 2.36729457789789 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.43994524392779e-10 2.30366918691731e-10 2.28330782764802e-10 2.30117259881694e-10 2.28739512836942e-10 2.30066405264939e-10 2.30513150331364e-10 2.36729457789789e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016254098683506794 1.2072710643859286 1.2451641185237416 1.2664096428122018 1.1998451859951031 1.0873398192458725 0.9046250639713938 0.33723156877700045 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01625409868350679 1.207271064385929 1.245164118523742 1.266409642812202 1.199845185995103 1.087339819245873 0.9046250639713938 0.3372315687770004 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "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 ] } }