{ "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" 3.17069959640503 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.17069959640503e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.70703004493278 2.36588553617924 2.35677887979942 2.39470592646679 2.4365831102382 2.38603650340429 2.4578866581316 2.64188093613822 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.707030044932781e-10 2.36588553617924e-10 2.35677887979942e-10 2.39470592646679e-10 2.4365831102382e-10 2.38603650340429e-10 2.4578866581316e-10 2.64188093613822e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.009602290200920353 2.236102386314822 2.2741443554517287 2.2393429251423704 2.2871084283842698 2.244109996979193 1.9025338250931936 0.9336245224853658 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.009602290200920353 2.236102386314822 2.274144355451729 2.23934292514237 2.28710842838427 2.244109996979193 1.902533825093194 0.9336245224853658 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Mo" "Mo" "Mo" "Mo" ] } "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 ] } }