{ "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" 3.6111526265740403 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.61115262657404e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "minimum-atom-separation" { "source-value" [ 2.52967169158379 2.22509665583388 2.23517134187685 2.24224875009433 2.24410622533037 2.21017587952926 2.15644593833926 2.24728438673684 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.52967169158379e-10 2.22509665583388e-10 2.23517134187685e-10 2.24224875009433e-10 2.24410622533037e-10 2.21017587952926e-10 2.15644593833926e-10 2.24728438673684e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02011883706554752 1.3972272286506484 1.3679170912146428 1.4242881403489764 1.3076782613270008 1.3755429723671488 1.4581656799829934 1.223009723360463 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02011883706554752 1.397227228650648 1.367917091214643 1.424288140348976 1.307678261327001 1.375542972367149 1.458165679982993 1.223009723360463 ] } "short-name" { "source-value" [ "fcc" ] } "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 ] } }