{ "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" 3.518474650382997 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.518474650382997e-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" [ 2.46773551869078 2.19360681284652 2.21677627515874 2.19940486681316 2.23601646692483 2.21732990887998 2.21176411843064 2.18533782322324 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46773551869078e-10 2.19360681284652e-10 2.21677627515874e-10 2.19940486681316e-10 2.23601646692483e-10 2.21732990887998e-10 2.21176411843064e-10 2.18533782322324e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02173473581909506 1.3318644055970914 1.3347712687724942 1.3288232573611112 1.2341478033968118 1.250692273208079 1.2780294270665977 1.0965284322629547 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02173473581909506 1.331864405597091 1.334771268772494 1.328823257361111 1.234147803396812 1.250692273208079 1.278029427066598 1.096528432262955 ] } "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 ] } }