{ "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" 3.522514119744301 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522514119744301e-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" [ 2.32036782606408 2.20397770743546 2.17592674616057 2.21738221947112 2.20265097224693 2.21415736693578 2.13030244883087 2.30419090520537 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.32036782606408e-10 2.20397770743546e-10 2.17592674616057e-10 2.21738221947112e-10 2.20265097224693e-10 2.21415736693578e-10 2.13030244883087e-10 2.30419090520537e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ -1.4678505259501147 -1.4609050413762676 -1.2221608573562213 -0.14438755632477512 -0.6945863592143164 -0.42896526722491146 -7.292175008231954 -0.7089410706284318 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ -1.467850525950115 -1.460905041376268 -1.222160857356221 -0.1443875563247751 -0.6945863592143164 -0.4289652672249115 -7.292175008231954 -0.7089410706284318 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "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 ] } }