{ "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" 4.050010219216347 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.050010219216347e-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" [ 2.83706703989069 2.57247289788718 2.54037236364027 2.59239357069032 2.58485519391006 2.5901168630552 2.53779965402278 2.67570186076957 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83706703989069e-10 2.57247289788718e-10 2.54037236364027e-10 2.59239357069032e-10 2.58485519391006e-10 2.5901168630552e-10 2.53779965402278e-10 2.67570186076957e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.0127580752104434 0.5721884175155627 0.5745557653569364 0.5748976474867613 0.5478388352679494 0.5430166635462077 0.5542847207032611 0.5592403273645367 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0127580752104434 0.5721884175155627 0.5745557653569364 0.5748976474867613 0.5478388352679494 0.5430166635462077 0.5542847207032611 0.5592403273645367 ] } "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 ] } }