{ "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" 3.917371600866318 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.917371600866318e-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" [ 2.74530877143621 2.41106349793682 2.46604103081697 2.41107176617054 2.47940208945791 2.44694274402076 2.40335273391647 2.45450882202886 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.74530877143621e-10 2.41106349793682e-10 2.46604103081697e-10 2.41107176617054e-10 2.47940208945791e-10 2.44694274402076e-10 2.40335273391647e-10 2.45450882202886e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02321289028686357 1.5933576178637079 1.5560041386052172 1.620634715994163 1.5057345742002126 1.5121020463797177 1.7508098462026276 1.5100712580555793 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02321289028686357 1.593357617863708 1.556004138605217 1.620634715994163 1.505734574200213 1.512102046379718 1.750809846202628 1.510071258055579 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }