{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6316919 -4.8002331 -19.4105842 ] [ -1.0663641 -1.9994635 3.6394968 ] [ -19.1805057 -11.0284128 11.9262685 ] [ -9.296707 7.2230514 -6.2525642 ] [ 20.7503732 -22.9948362 17.588822 ] [ 4.2938908 22.6371273 -18.1065303 ] [ 5.1310048 10.962767 10.6150914 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.012081993728732e-09 -7.690821247210308e-09 -3.109918420130987e-08 ] [ -1.708503630280433e-09 -3.203493673842941e-09 5.831116684436413e-09 ] [ -3.073055780766114e-08 -1.766946515269147e-08 1.910798856408348e-08 ] [ -1.489496660582771e-08 1.157260408391671e-08 -1.001771218129106e-08 ] [ 3.324576281391488e-08 -3.684178895876551e-08 2.81803993958127e-08 ] [ 6.879571452028208e-09 3.626867612213343e-08 -2.900985953046681e-08 ] [ 8.22077593177258e-09 1.756428898667775e-08 1.700725126873514e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7592287 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.243165481858038e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9488147 1.3494839 1.149562 ] [ 1.9863984 2.4456632 5.3644408 ] [ 1.1902008 1.2866202 3.0289796 ] [ 0.6717515 3.8103965 3.3762394 ] [ 3.8921951 1.6539471 3.6929485 ] [ 4.3168678 3.4738164 1.7031808 ] [ 3.1711967 4.3627837 3.830637 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9488147e-10 1.3494839e-10 1.149562e-10 ] [ 1.9863984e-10 2.4456632e-10 5.364440799999999e-10 ] [ 1.1902008e-10 1.2866202e-10 3.0289796e-10 ] [ 6.717515e-11 3.8103965e-10 3.3762394e-10 ] [ 3.8921951e-10 1.6539471e-10 3.6929485e-10 ] [ 4.3168678e-10 3.4738164e-10 1.7031808e-10 ] [ 3.1711967e-10 4.3627837e-10 3.830637e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.15e-05 2.1e-06 3.4e-06 ] [ 3.3e-06 -1.65e-05 -8.3e-06 ] [ -2.65e-05 5.2e-06 9e-07 ] [ 3.1e-06 -1e-07 6.2e-06 ] [ 1.29e-05 -2.3e-06 1.26e-05 ] [ -5.3e-06 1.1e-06 2.4e-06 ] [ 1e-06 1.05e-05 -1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.84250311392e-14 3.36457090368e-15 5.44740051072e-15 ] [ 5.28718284864e-15 -2.64359142432e-14 -1.329806595264e-14 ] [ -4.24576804512e-14 8.33131842816e-15 1.44195895872e-15 ] [ 4.96674752448e-15 -1.6021766208e-16 9.93349504896e-15 ] [ 2.066807840832e-14 -3.68500622784e-15 2.018742542208e-14 ] [ -8.491536090240001e-15 1.76239428288e-15 3.84522388992e-15 ] [ 1.6021766208e-15 1.68228545184e-14 -2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.670425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.792420153939984e-18 } }