{ "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" 4.210700303316116 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.210700303316116e-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" [ 2.94706442967879 2.69710730697001 2.70609866490433 2.73759165772233 2.77408930229604 2.71911759342424 2.68670071929024 2.77131544012797 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.94706442967879e-10 2.69710730697001e-10 2.70609866490433e-10 2.73759165772233e-10 2.77408930229604e-10 2.71911759342424e-10 2.68670071929024e-10 2.77131544012797e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012987084676654641 0.1935363264668251 0.18380806767597627 0.17793765779995116 0.16009699209589076 0.16876767757625394 0.17534814531581613 0.1323502868317791 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01298708467665464 0.1935363264668251 0.1838080676759763 0.1779376577999512 0.1600969920958908 0.1687676775762539 0.1753481453158161 0.1323502868317791 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }