{ "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" 4.045353233814239 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.045353233814239e-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" [ 2.83481235585153 2.50369587886302 2.4815554831651 2.53379441654489 2.51355407775352 2.48482378694441 2.44506460169475 2.46497665166116 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83481235585153e-10 2.50369587886302e-10 2.4815554831651e-10 2.53379441654489e-10 2.51355407775352e-10 2.48482378694441e-10 2.44506460169475e-10 2.46497665166116e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012675771157578201 0.6166961080220829 0.6214897523909887 0.6303029861965225 0.6167694270201433 0.612738725207367 0.6793123228995959 0.6319880797983817 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0126757711575782 0.6166961080220829 0.6214897523909887 0.6303029861965225 0.6167694270201433 0.612738725207367 0.6793123228995959 0.6319880797983817 ] } "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 ] } }