{ "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" 3.1465589627623562 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.146558962762357e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.71888024905503 2.48239912801915 2.51280456146374 2.46808555681435 2.4768368453144 2.53105955434976 2.51551042542902 2.49632629928474 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.71888024905503e-10 2.48239912801915e-10 2.51280456146374e-10 2.46808555681435e-10 2.4768368453144e-10 2.53105955434976e-10 2.51551042542902e-10 2.49632629928474e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.021303041268028317 1.8925742734212079 1.9094444435050457 1.9530515013410321 1.8503107458098411 1.5818995002576632 1.3605769727315653 0.4804753623378674 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02130304126802832 1.892574273421208 1.909444443505046 1.953051501341032 1.850310745809841 1.581899500257663 1.360576972731565 0.4804753623378674 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Mo" "Mo" "Mo" "Mo" ] } "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 ] } }