{ "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" 3.920081233978273 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.920081233978273e-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" [ 2.74787818303989 2.45599702172178 2.45172460139915 2.45763891464334 2.52529945717405 2.4459472137527 2.42634349164314 2.4471848200682 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.74787818303989e-10 2.45599702172178e-10 2.45172460139915e-10 2.45763891464334e-10 2.52529945717405e-10 2.4459472137527e-10 2.42634349164314e-10 2.4471848200682e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.023180800469527703 0.8930980126903971 0.9051719054067228 0.8936352404482856 0.8363063271893807 0.8343946407189019 0.8792124567143577 0.962343657994923 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0231808004695277 0.8930980126903971 0.9051719054067228 0.8936352404482856 0.8363063271893807 0.8343946407189019 0.8792124567143577 0.962343657994923 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Pt" "Pt" "Pt" "Pt" ] } "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 ] } }