{ "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" 3.5199999883770943 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519999988377094e-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" [ 2.4700421239871 2.21274575813813 2.27459170108014 2.23108856470553 2.27139606699236 2.27092490224832 2.24447455149773 2.3645926084588 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.4700421239871e-10 2.21274575813813e-10 2.27459170108014e-10 2.23108856470553e-10 2.27139606699236e-10 2.27092490224832e-10 2.24447455149773e-10 2.3645926084588e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022237440265604123 1.1647680507789617 1.180897993272572 1.1957903910388217 1.1528548577872848 1.1603095923923898 1.17080076295315 1.0658732842463279 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02223744026560412 1.164768050778962 1.180897993272572 1.195790391038822 1.152854857787285 1.16030959239239 1.17080076295315 1.065873284246328 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }