{ "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" 3.639087408781052 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.639087408781052e-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" [ 2.54997005054574 2.18131761267813 2.14800315394948 2.19185813472159 2.30392627941483 2.05664958568589 2.12524900061976 2.17175472498654 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.54997005054574e-10 2.18131761267813e-10 2.14800315394948e-10 2.19185813472159e-10 2.30392627941483e-10 2.05664958568589e-10 2.12524900061976e-10 2.17175472498654e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015303780628135146 1.0130294762347414 1.0138922259900887 1.0241413649269522 0.9831544610696937 0.9715741075877595 0.9589775292641289 1.0013611722026732 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01530378062813515 1.013029476234741 1.013892225990089 1.024141364926952 0.9831544610696937 0.9715741075877595 0.9589775292641289 1.001361172202673 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }