{ "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" 3.869337007403374 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.869337007403374e-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" [ 2.70995529805407 2.45618420957441 2.46517800450617 2.46697711640402 2.50825702272992 2.51752599090696 2.46825043176645 2.56161213603839 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.70995529805407e-10 2.456184209574411e-10 2.46517800450617e-10 2.46697711640402e-10 2.50825702272992e-10 2.51752599090696e-10 2.46825043176645e-10 2.56161213603839e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.013265284166634748 0.7977755038712077 0.8112563966895792 0.8036813329164497 0.7457409390163113 0.7331576178682525 0.7733745136719437 0.6849410445359339 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01326528416663475 0.7977755038712077 0.8112563966895792 0.8036813329164497 0.7457409390163113 0.7331576178682525 0.7733745136719437 0.6849410445359339 ] } "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 ] } }