{ "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" 4.044650778174401 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.044650778174401e-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" [ 2.83404909724138 2.53469564179776 2.50538591251329 2.52048210302492 2.53582102832576 2.50270452471604 2.4635526233224 2.49064956921827 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83404909724138e-10 2.53469564179776e-10 2.50538591251329e-10 2.52048210302492e-10 2.53582102832576e-10 2.50270452471604e-10 2.4635526233224e-10 2.49064956921827e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012680026588016254 0.6197220022545403 0.6251317480098739 0.6348531987368335 0.6214472262455447 0.6239267027528432 0.6640185216557115 0.6432767299144632 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01268002658801625 0.6197220022545403 0.6251317480098739 0.6348531987368335 0.6214472262455447 0.6239267027528432 0.6640185216557115 0.6432767299144632 ] } "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 ] } }