{ "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" 3.520000994205475 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000994205475e-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" [ 2.46732961319962 2.25496178017032 2.26862993175594 2.26570525759995 2.30887042799139 2.28773654636316 2.28723100477552 2.32675693853116 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46732961319962e-10 2.25496178017032e-10 2.26862993175594e-10 2.26570525759995e-10 2.30887042799139e-10 2.28773654636316e-10 2.28723100477552e-10 2.32675693853116e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02199001128902171 1.283190541829144 1.2895900080581153 1.3163807222114936 1.2464667592900638 1.2548130546811531 1.2634032121683871 1.3504128745995025 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02199001128902171 1.283190541829144 1.289590008058115 1.316380722211494 1.246466759290064 1.254813054681153 1.263403212168387 1.350412874599503 ] } "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 ] } }