{ "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" 4.0415970236062995 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.041597023606299e-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" [ 2.83645264398601 2.42792906454019 2.48053559371114 2.41361985114383 2.49775238558908 2.45289310610954 2.37698829242197 2.41130514613403 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83645264398601e-10 2.42792906454019e-10 2.48053559371114e-10 2.41361985114383e-10 2.49775238558908e-10 2.45289310610954e-10 2.37698829242197e-10 2.41130514613403e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012736192113137187 0.7242772661364987 0.7402673077579064 0.761047448751775 0.6394649475171846 0.6408001107935324 0.7229304837480569 0.7758420543570381 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01273619211313719 0.7242772661364987 0.7402673077579064 0.761047448751775 0.6394649475171846 0.6408001107935324 0.7229304837480569 0.7758420543570381 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }