{ "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" 4.949355721473694 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.949355721473694e-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" [ 3.46685550932721 3.13879422698207 3.15170413860236 3.14730883591695 3.21864382791923 3.16582557916628 3.16867547899218 3.28189637494179 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.46685550932721e-10 3.13879422698207e-10 3.15170413860236e-10 3.14730883591695e-10 3.21864382791923e-10 3.16582557916628e-10 3.16867547899218e-10 3.28189637494179e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.005090923475143357 0.21863487865760875 0.21971104347201553 0.22029499838701821 0.2078806485607346 0.19914558752311273 0.20962261778763602 0.205576489982457 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.005090923475143357 0.2186348786576087 0.2197110434720155 0.2202949983870182 0.2078806485607346 0.1991455875231127 0.209622617787636 0.205576489982457 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" ] } "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 ] } }