{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3881793 -16.9079623 -20.7902525 ] [ -18.9558223 -28.8740281 6.3757671 ] [ -25.0521855 26.1953407 14.5407995 ] [ 21.2184596 6.1396918 -43.3981835 ] [ 24.3887203 -35.1065317 26.0876791 ] [ 12.7890073 48.5534897 17.1841903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.305240449033851e-08 -2.70895419024278e-08 -3.330965649602876e-08 ] [ -3.037057531709929e-08 -4.626129277014225e-08 1.021510498728581e-08 ] [ -4.013802590804475e-08 4.196956244343071e-08 2.329692900664033e-08 ] [ 3.399571990050932e-08 9.83687066087747e-09 -6.953155498888832e-08 ] [ 3.907503747589036e-08 -5.624686432711408e-08 4.179706954495279e-08 ] [ 2.049024849930053e-08 7.779126605559361e-08 2.753210794603814e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 22.056538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.533846951938679e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8811561 -0.1530467 0.4546647 ] [ 0.0829723 -0.4419574 2.7872499 ] [ 0.4162336 1.9300959 1.9984487 ] [ 2.530864 1.7591107 0.4370568 ] [ 2.525147 0.1152197 2.495316 ] [ 2.7208708 2.6156187 2.7590874 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.811561e-11 -1.530467e-11 4.546647e-11 ] [ 8.29723e-12 -4.419574e-11 2.7872499e-10 ] [ 4.162336e-11 1.9300959e-10 1.9984487e-10 ] [ 2.530864e-10 1.7591107e-10 4.370568e-11 ] [ 2.525147e-10 1.152197e-11 2.495316e-10 ] [ 2.7208708e-10 2.6156187e-10 2.7590874e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.19e-05 -1.92e-05 4.06e-05 ] [ -2.43e-05 -8.8e-06 1.63e-05 ] [ -9.99e-05 -1.36e-05 -1.29e-05 ] [ 7.43e-05 6.17e-05 -7.85e-05 ] [ 7.4e-06 -7.94e-05 -7.4e-06 ] [ 5.44e-05 5.93e-05 4.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.906590178752e-14 -3.076179111936e-14 6.504837080448e-14 ] [ -3.893289188544e-14 -1.409915426304e-14 2.611547891904e-14 ] [ -1.6005744441792e-13 -2.178960204288e-14 -2.066807840832e-14 ] [ 1.1904172292544e-13 9.885429750336e-14 -1.257708647328e-13 ] [ 1.185610699392e-14 -1.2721282369152e-13 -1.185610699392e-14 ] [ 8.715840817152e-14 9.500907361344e-14 6.697098274944e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }