{ "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" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.9787956 -26.8150494 -0.8930756 ] [ -14.1769318 25.7905084 -24.5721873 ] [ -3.4838258 23.9441989 24.2382707 ] [ 6.4077879 -11.858893 -31.1360254 ] [ 44.2638751 -20.4776692 32.0404273 ] [ 4.9678902 9.4169043 0.3225904 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.084873889778201e-08 -4.296244558823571e-08 -1.43086485871553e-09 ] [ -2.271394887177156e-08 4.132094993746073e-08 -3.936898433833154e-08 ] [ -5.581704293686357e-09 3.83628359974285e-08 3.883399096410682e-08 ] [ 1.026640804900793e-08 -1.900004126970616e-08 -4.98854123715105e-08 ] [ 7.09185464155144e-08 -3.280884311102147e-08 5.13344239634357e-08 ] [ 7.959437598717586e-09 1.508754403407413e-08 5.168468012327135e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 21.384346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.426149949457136e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3018155 1.2904976 1.5640107 ] [ 0.6187933 2.8617842 -0.3445177 ] [ 0.7123863 1.3666633 4.0227722 ] [ 2.5502891 1.1198917 0.1977805 ] [ 2.6338501 0.6009365 2.6340887 ] [ 2.938648 3.1427547 -1.208301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.018155e-11 1.2904976e-10 1.5640107e-10 ] [ 6.187933e-11 2.8617842e-10 -3.445177e-11 ] [ 7.123863e-11 1.3666633e-10 4.022772200000001e-10 ] [ 2.5502891e-10 1.1198917e-10 1.977805e-11 ] [ 2.6338501e-10 6.009365e-11 2.6340887e-10 ] [ 2.938648e-10 3.1427547e-10 -1.208301e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.67e-05 2.56e-05 -3.01e-05 ] [ 8.2e-06 -2.55e-05 3.4e-05 ] [ -3.3e-06 -2.45e-05 2.39e-05 ] [ -1.36e-05 -3.68e-05 3.35e-05 ] [ -1.97e-05 3.29e-05 -2.35e-05 ] [ 1.17e-05 2.82e-05 -3.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.67563497878e-14 4.10157218304e-14 -4.82255166834e-14 ] [ 1.31378483988e-14 -4.0855504167e-14 5.447400555599999e-14 ] [ -5.2871828922e-15 -3.925332753299999e-14 3.82920215526e-14 ] [ -2.17896022224e-14 -5.896010013119999e-14 5.367291723899999e-14 ] [ -3.15628796898e-14 5.271161125859999e-14 -3.765115089899999e-14 ] [ 1.87454666178e-14 4.51813810788e-14 -6.056227676519999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.113757 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.101055504935394e-18 } }