{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2205921 -2.3039961 -4.8303369 ] [ -11.4374015 -15.7283541 1.2365825 ] [ -15.5658865 5.9103091 20.4626426 ] [ -6.1012221 4.5362344 -4.2981539 ] [ 7.7345507 -8.2525682 -16.4912143 ] [ 20.5791013 -2.4215125 11.7628501 ] [ 9.0114503 18.2598876 -7.84237 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.762133988553176e-09 -3.691408685834379e-09 -7.739052851767548e-09 ] [ -1.832473728600285e-08 -2.519960122268383e-08 1.981223571190416e-09 ] [ -2.493929943232634e-08 9.46935906172149e-09 3.278476757350612e-08 ] [ -9.77523540692828e-09 7.267848702148716e-09 -6.886401691180341e-09 ] [ 1.239211630393227e-08 -1.322207183159754e-08 -2.642183800006264e-08 ] [ 3.297135497993489e-08 -3.879690714474961e-09 1.884616342419494e-08 ] [ 1.443793499016115e-08 2.925556501115582e-08 -1.25648618656633e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.1425872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.144368622386533e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1090779 1.6902134 1.9096465 ] [ 2.1309084 0.1444661 3.4657803 ] [ 2.4004527 2.0395282 5.1153796 ] [ 1.6991037 3.6077915 3.2623428 ] [ 4.510462 0.2271667 3.0346068 ] [ 4.7719876 2.2860541 4.2786378 ] [ 4.0324927 4.0607388 2.8093983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1090779e-10 1.6902134e-10 1.9096465e-10 ] [ 2.1309084e-10 1.444661e-11 3.4657803e-10 ] [ 2.4004527e-10 2.0395282e-10 5.1153796e-10 ] [ 1.6991037e-10 3.6077915e-10 3.2623428e-10 ] [ 4.510462e-10 2.271667e-11 3.0346068e-10 ] [ 4.7719876e-10 2.2860541e-10 4.2786378e-10 ] [ 4.0324927e-10 4.0607388e-10 2.8093983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.19e-05 5e-07 1.7e-06 ] [ -9.2e-06 -7.3e-06 1.97e-05 ] [ 4.1e-06 2e-07 -1.32e-05 ] [ 1.78e-05 -2.07e-05 -7.4e-06 ] [ -2.47e-05 4.04e-05 -2.1e-05 ] [ 4.9e-06 -3.1e-06 2.17e-05 ] [ -4.8e-06 -1e-05 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906590178752e-14 8.010883104e-16 2.72370025536e-15 ] [ -1.474002491136e-14 -1.169588933184e-14 3.156287942976e-14 ] [ 6.568924145279999e-15 3.2043532416e-16 -2.114873139456e-14 ] [ 2.851874385024e-14 -3.316505605055999e-14 -1.185610699392e-14 ] [ -3.957376253376001e-14 6.472793548032e-14 -3.36457090368e-14 ] [ 7.850665441919999e-15 -4.96674752448e-15 3.476723267136e-14 ] [ -7.69044777984e-15 -1.6021766208e-14 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.350653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.619663397141338e-18 } }