{ "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" [ [ 1.413305 1.605976 1.085725 ] [ 1.596802 1.851301 3.402769 ] [ 1.403818 3.874197 1.795071 ] [ 3.61937 1.350758 2.07249 ] [ 3.606514 2.808679 3.770695 ] [ 3.997077 3.808366 1.42443 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.413305e-10 1.605976e-10 1.085725e-10 ] [ 1.596802e-10 1.851301e-10 3.402769e-10 ] [ 1.403818e-10 3.874197e-10 1.795071e-10 ] [ 3.61937e-10 1.350758e-10 2.07249e-10 ] [ 3.606514e-10 2.808679e-10 3.770695e-10 ] [ 3.997077e-10 3.808366e-10 1.42443e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1703841 -1.6029921 -3.1121488 ] [ -3.7319863 -0.5773453 2.8099849 ] [ 0.5512542 1.2588736 -0.1026442 ] [ 2.0163163 -3.1343711 -3.6213579 ] [ 2.9858165 3.7621778 3.5859332 ] [ -0.6510166 0.2936571 0.4402328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.875162042376049e-09 -2.568276465947096e-09 -4.986212047810775e-09 ] [ -5.979301199005895e-09 -9.250091417887621e-10 4.502092111581026e-09 ] [ 8.832065913578075e-10 2.016937850462331e-09 -1.644541375007194e-10 ] [ 3.230494835997959e-09 -5.021816097331179e-09 -5.802054962929384e-09 ] [ 4.783805390298883e-09 6.027673314452779e-09 5.745298336790531e-09 ] [ -1.043043576272705e-09 4.704905401519277e-10 7.053306998693222e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.804189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.891239564330453e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2390999 1.3567429 0.9568732 ] [ 1.575829 2.1081707 3.446874 ] [ 1.4099368 3.8194191 1.5147349 ] [ 3.6183305 1.3334 1.8529611 ] [ 3.962579 2.7722248 4.0184643 ] [ 3.8311108 3.9093195 1.7612725 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2390999e-10 1.3567429e-10 9.568732e-11 ] [ 1.575829e-10 2.1081707e-10 3.446874e-10 ] [ 1.4099368e-10 3.819419100000001e-10 1.5147349e-10 ] [ 3.6183305e-10 1.3334e-10 1.8529611e-10 ] [ 3.962579e-10 2.7722248e-10 4.0184643e-10 ] [ 3.8311108e-10 3.9093195e-10 1.7612725e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -7.6e-06 9e-07 ] [ 7.8e-06 2.8e-06 -4.9e-06 ] [ -6.1e-06 3.8e-06 4.1e-06 ] [ -8.2e-06 -4.3e-06 -3.4e-06 ] [ -5.5e-06 4.7e-06 -4.6e-06 ] [ 8.7e-06 6e-07 7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -1.217654231808e-14 1.44195895872e-15 ] [ 1.249697764224e-14 4.48609453824e-15 -7.850665441919999e-15 ] [ -9.77327738688e-15 6.08827115904e-15 6.568924145279999e-15 ] [ -1.313784829056e-14 -6.889359469440001e-15 -5.44740051072e-15 ] [ -8.8119714144e-15 7.53023011776e-15 -7.370012455680001e-15 ] [ 1.393893660096e-14 9.6130597248e-16 1.265719530432e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.657752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.188213094708444e-18 } }