{ "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" 2.863645777106285 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863645777106285e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47653872646277 2.31307872255264 2.3213316148082 2.22412872182502 2.28537774247851 2.32854021510865 2.30834598990093 2.3147811910193 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47653872646277e-10 2.31307872255264e-10 2.3213316148082e-10 2.22412872182502e-10 2.28537774247851e-10 2.32854021510865e-10 2.30834598990093e-10 2.3147811910193e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016181394304998757 1.1211621579951465 1.1445235514510876 1.1502417529778937 1.0954803619775813 0.9703463980833639 0.8611140941049543 0.32507388768286344 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01618139430499876 1.121162157995147 1.144523551451088 1.150241752977894 1.095480361977581 0.9703463980833639 0.8611140941049543 0.3250738876828634 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "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 ] } }