{ "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" 3.5213917642831802 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52139176428318e-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" [ 2.47083139443238 2.20913711147892 2.22031161858759 2.22255041330602 2.28394002896276 2.21522585194197 2.21742112523039 2.36289645593827 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47083139443238e-10 2.20913711147892e-10 2.22031161858759e-10 2.22255041330602e-10 2.28394002896276e-10 2.21522585194197e-10 2.21742112523039e-10 2.36289645593827e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022216976291309594 1.4450256875857834 1.4475573662177168 1.4469263898421743 1.3696722374149308 1.318562758023994 1.3562333546300416 1.0462295709962435 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02221697629130959 1.445025687585783 1.447557366217717 1.446926389842174 1.369672237414931 1.318562758023994 1.356233354630042 1.046229570996243 ] } "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 ] } }