{ "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" 4.044527357816695 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.044527357816695e-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" [ 2.8355978679929 2.56440231614897 2.54433703044634 2.51795662154641 2.55667638046134 2.5563510535268 2.51459559294779 2.59126974588561 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.8355978679929e-10 2.56440231614897e-10 2.54433703044634e-10 2.51795662154641e-10 2.55667638046134e-10 2.5563510535268e-10 2.51459559294779e-10 2.59126974588561e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01249903614563512 0.5113737443761444 0.49646715034004957 0.495741223007793 0.4591003724470549 0.4558327433618265 0.5422293328269746 0.5148795451896958 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01249903614563512 0.5113737443761444 0.4964671503400496 0.495741223007793 0.4591003724470549 0.4558327433618265 0.5422293328269746 0.5148795451896958 ] } "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 ] } }