{ "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" 3.613315634429455 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.613315634429455e-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" [ 2.53110369267376 2.26299498265101 2.25480720617086 2.27159011125723 2.26640829973681 2.27518565197943 2.22102240380836 2.27524949208769 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53110369267376e-10 2.26299498265101e-10 2.25480720617086e-10 2.27159011125723e-10 2.26640829973681e-10 2.27518565197943e-10 2.22102240380836e-10 2.27524949208769e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016739188813131228 1.0743579614462555 1.0814772399431607 1.0893718869791233 0.9699374265972611 0.9816318472326026 1.0806592068750749 1.0225164571791734 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01673918881313123 1.074357961446256 1.081477239943161 1.089371886979123 0.9699374265972611 0.9816318472326026 1.080659206875075 1.022516457179173 ] } "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 ] } }