{ "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" 3.608429037034512 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.608429037034512e-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" [ 2.5280548267392 2.2242269688273 2.27041165828577 2.25148472514469 2.24254671716282 2.25078836891956 2.17197712485552 2.25794671223268 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.5280548267392e-10 2.2242269688273e-10 2.27041165828577e-10 2.25148472514469e-10 2.24254671716282e-10 2.25078836891956e-10 2.17197712485552e-10 2.25794671223268e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.020218298726438624 0.9206157103029295 0.883222182417353 0.9258927274891917 0.7918119078123891 0.8992230924310524 0.6560988798949657 0.6089118804326357 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02021829872643862 0.9206157103029295 0.883222182417353 0.9258927274891917 0.7918119078123891 0.8992230924310524 0.6560988798949657 0.6089118804326357 ] } "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 ] } }