{ "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" 4.939586490392685 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.939586490392685e-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" [ 3.45969340482552 3.1318369202977 3.13964171593847 3.12772218028829 3.18884681362954 3.15025921653055 3.10831826096137 3.28770797663084 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.45969340482552e-10 3.1318369202977e-10 3.13964171593847e-10 3.12772218028829e-10 3.18884681362954e-10 3.15025921653055e-10 3.10831826096137e-10 3.28770797663084e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.005102697922900094 0.5851623147409204 0.5876068666055948 0.6092193262280267 0.5731712782370416 0.5378006688194005 0.5602517439352888 0.527131940178252 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.005102697922900094 0.5851623147409204 0.5876068666055948 0.6092193262280267 0.5731712782370416 0.5378006688194005 0.5602517439352888 0.527131940178252 ] } "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 ] } }