{ "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" 2.570972137153149 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.570972137153149e-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" [ 0.787843676170258 0.766654522399869 1.39203273657411 1.40927354696134 0.846015331465634 0.731167216757302 0.831442434104108 0.690829478664348 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.878436761702579e-11 7.66654522399869e-11 1.39203273657411e-10 1.40927354696134e-10 8.46015331465634e-11 7.31167216757302e-11 8.31442434104108e-11 6.90829478664348e-11 ] } "relaxed-grain-boundary-energy" { "source-value" [ 690.6387306534568 1138.2113304435618 1002.7369103177452 583.4702840267709 737.2460723195809 609.9802514505576 1087.2319649583528 650.7981044769376 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 690.6387306534568 1138.211330443562 1002.736910317745 583.4702840267709 737.2460723195809 609.9802514505576 1087.231964958353 650.7981044769376 ] } "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 ] } }