{ "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" [ [ 2.051273 2.837998 1.545633 ] [ 2.498541 2.310424 3.735737 ] [ 1.453493 4.519355 3.131974 ] [ 4.173987 2.427158 6.121254 ] [ 4.520065 2.264664 3.31985 ] [ 3.501394 4.313188 2.351729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.051273e-10 2.837998e-10 1.545633e-10 ] [ 2.498541e-10 2.310424e-10 3.735737e-10 ] [ 1.453493e-10 4.519355e-10 3.131974e-10 ] [ 4.173987e-10 2.427158e-10 6.121254e-10 ] [ 4.520065e-10 2.264664e-10 3.31985e-10 ] [ 3.501394e-10 4.313188e-10 2.351729e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.980153 -1.6669739 -2.6261789 ] [ -6.5663838 -1.4786201 5.424415 ] [ -2.5093864 0.903367 1.309144 ] [ -0.7485015 -0.4018264 -6.8152797 ] [ 6.8599261 1.1129784 3.2067206 ] [ 4.9444986 1.5310749 -0.4988211 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.172554842206983e-09 -2.670786610063797e-09 -4.207602435618262e-09 ] [ -1.052050660755986e-08 -2.369010555264958e-09 8.690870894516832e-09 ] [ -4.020480222633477e-09 1.447353487402234e-09 2.097479910060595e-09 ] [ -1.199231603933731e-09 -6.437968637002292e-10 -1.091928179955284e-08 ] [ 1.099081321783572e-08 1.783187971935391e-09 5.137732774757749e-09 ] [ 7.92196005849833e-09 2.453052409473698e-09 -7.991995043817389e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.729584 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.039504187730975e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9414262 2.8172154 1.5989891 ] [ 2.294073 2.0375582 3.8862331 ] [ 1.7438512 4.3679947 3.4608781 ] [ 3.8192722 2.555249 5.6720649 ] [ 4.647256 2.5842521 3.4588507 ] [ 3.7528744 4.3105177 2.1291611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9414262e-10 2.8172154e-10 1.5989891e-10 ] [ 2.294073e-10 2.0375582e-10 3.8862331e-10 ] [ 1.7438512e-10 4.3679947e-10 3.4608781e-10 ] [ 3.8192722e-10 2.555249e-10 5.6720649e-10 ] [ 4.647256e-10 2.5842521e-10 3.4588507e-10 ] [ 3.7528744e-10 4.310517700000001e-10 2.1291611e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 7.2e-06 1.01e-05 ] [ -3e-07 -5.2e-06 -1.56e-05 ] [ 9.9e-06 -4.9e-06 6.9e-06 ] [ -1.39e-05 7.6e-06 1.24e-05 ] [ 1.07e-05 1.02e-05 -1.28e-05 ] [ -1.7e-06 -1.49e-05 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012455680001e-15 1.153567166976e-14 1.618198387008e-14 ] [ -4.8065298624e-16 -8.33131842816e-15 -2.499395528448e-14 ] [ 1.586154854592e-14 -7.850665441919999e-15 1.105501868352e-14 ] [ -2.227025502912e-14 1.217654231808e-14 1.986699009792e-14 ] [ 1.714328984256e-14 1.634220153216e-14 -2.050786074624e-14 ] [ -2.72370025536e-15 -2.387243164992e-14 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.407485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.788986549392669e-18 } }