{ "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" 3.524220451712608 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.524220451712608e-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" [ 2.47404852283636 2.23063339531353 2.24328185561674 2.25759990301755 2.33137003835753 2.22763538942524 2.23499044386954 2.37013826169649 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47404852283636e-10 2.23063339531353e-10 2.24328185561674e-10 2.25759990301755e-10 2.33137003835753e-10 2.22763538942524e-10 2.23499044386954e-10 2.37013826169649e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022231442530994464 1.3214428359274908 1.2968085275590968 1.3437955011278782 1.2438083687056865 1.3069692906015369 1.304102218367248 1.1986479701089874 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02223144253099446 1.321442835927491 1.296808527559097 1.343795501127878 1.243808368705686 1.306969290601537 1.304102218367248 1.198647970108987 ] } "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 ] } }