{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.4601681e-10 1.8651597e-10 2.5578058e-10 ] [ 2.6080046e-10 3.0235318e-10 4.4838783e-10 ] [ 1.9526144e-10 4.333888800000001e-10 2.4090592e-10 ] [ 3.6389413e-10 1.3308756e-10 1.5868436e-10 ] [ 4.825697100000001e-10 2.5046123e-10 3.4773384e-10 ] [ 4.160487200000001e-10 3.7924096e-10 1.3920265e-10 ] [ 4.0716763e-10 4.9072343e-10 3.6562232e-10 ] ] "source-value" [ [ 1.4601681 1.8651597 2.5578058 ] [ 2.6080046 3.0235318 4.4838783 ] [ 1.9526144 4.3338888 2.4090592 ] [ 3.6389413 1.3308756 1.5868436 ] [ 4.8256971 2.5046123 3.4773384 ] [ 4.1604872 3.7924096 1.3920265 ] [ 4.0716763 4.9072343 3.6562232 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.23799602638144e-12 -1.598763984597696e-11 1.04141480352e-14 ] [ -1.183607978616e-11 5.520940417614721e-12 6.3478237716096e-12 ] [ 1.309843474568832e-11 -4.75013324534784e-12 6.9678661238592e-13 ] [ -6.981003972149761e-12 3.40959206672448e-12 -6.724815930483841e-12 ] [ -7.937182979443201e-13 -1.743472576988352e-11 -2.72802613223616e-12 ] [ -3.32675953542912e-12 3.5904778072128e-12 1.99823468146176e-12 ] [ 4.60129103727552e-12 2.565132835199424e-11 3.9942263156544e-13 ] ] "source-value" [ [ 0.0032693 -0.0099787 6.5e-06 ] [ -0.0073875 0.0034459 0.003962 ] [ 0.0081754 -0.0029648 0.0004349 ] [ -0.0043572 0.0021281 -0.0041973 ] [ -0.0004954 -0.0108819 -0.0017027 ] [ -0.0020764 0.002241 0.0012472 ] [ 0.0028719 0.0160103 0.0002493 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.256352824965315e-18 "source-value" -26.566065 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.927004696688312e-08 -1.868269718879861e-08 -1.007287928800441e-08 ] [ 7.337231441365445e-09 -2.04395679677784e-09 2.519936890707381e-08 ] [ -1.716832080812442e-08 3.12903568770097e-08 -1.170495685042542e-08 ] [ 2.884820263312835e-09 -1.499689515983106e-08 -7.19519031283076e-09 ] [ 1.782753061091674e-08 -1.079529880371119e-08 1.336738364348593e-08 ] [ 5.661488477756483e-09 8.989809814955559e-10 -3.10472730379253e-08 ] [ 2.727297141873696e-09 1.432950993039578e-08 2.14535467784085e-08 ] ] "source-value" [ [ -12.0274174 -11.6608225 -6.2869968 ] [ 4.5795397 -1.2757375 15.7282091 ] [ -10.7156231 19.5299048 -7.3056595 ] [ 1.8005632 -9.3603258 -4.4908846 ] [ 11.1270695 -6.7378956 8.3432647 ] [ 3.5336232 0.5610998 -19.3781838 ] [ 1.702245 8.9437767 13.3902508 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.779077107161742e-18 "source-value" -11.104126 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] "source-value" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] } "instance-id" 1 }