{ "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" 3.519999995827675 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519999995827675e-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" [ 2.46687463291391 2.2198259886338 2.22807474183379 2.22097989595684 2.22647372101048 2.25053156963588 2.21818524430862 2.22092514181039 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46687463291391e-10 2.2198259886338e-10 2.22807474183379e-10 2.22097989595684e-10 2.22647372101048e-10 2.25053156963588e-10 2.21818524430862e-10 2.22092514181039e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022170328809821414 1.2524758998523646 1.2512237203226302 1.2490743584231665 1.1785751214720472 1.2093213585633025 1.2300540558109985 1.2714050455648456 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02217032880982141 1.252475899852365 1.25122372032263 1.249074358423166 1.178575121472047 1.209321358563302 1.230054055810998 1.271405045564846 ] } "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 ] } }