{ "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" 3.5196183800697343 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519618380069734e-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" [ 2.46956199151421 2.20112761535363 2.20474626375705 2.23487371213445 2.26933411270895 2.26516593594274 2.25697627742195 2.14783257573157 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46956199151421e-10 2.20112761535363e-10 2.20474626375705e-10 2.23487371213445e-10 2.26933411270895e-10 2.26516593594274e-10 2.25697627742195e-10 2.14783257573157e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02242408635588608 1.2650740452156441 1.2799879585713239 1.2912036374545637 1.238399566083177 1.2531930500568083 1.26434005231737 1.0507532212964381 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02242408635588608 1.265074045215644 1.279987958571324 1.291203637454564 1.238399566083177 1.253193050056808 1.26434005231737 1.050753221296438 ] } "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 ] } }