{ "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" 3.521391749382019 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.521391749382019e-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" [ 2.47155951937464 2.20978821894373 2.23481444032985 2.23960955083859 2.28154034044009 2.25632074789719 2.19909265931529 2.37456102603028 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47155951937464e-10 2.20978821894373e-10 2.23481444032985e-10 2.23960955083859e-10 2.28154034044009e-10 2.25632074789719e-10 2.19909265931529e-10 2.37456102603028e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022218727287425636 1.6044290952793516 1.612007637855605 1.6336456996573079 1.576986766739924 1.5566559580169763 1.5925576458645103 1.3127275562582652 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02221872728742564 1.604429095279352 1.612007637855605 1.633645699657308 1.576986766739924 1.556655958016976 1.59255764586451 1.312727556258265 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }