{ "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" [ [ 1.41976 2.173724 1.743633 ] [ 1.73064 2.628356 3.804992 ] [ 2.229685 4.150034 1.946802 ] [ 3.641834 1.485515 2.800746 ] [ 4.113003 2.080099 4.963049 ] [ 4.173975 3.620344 3.169433 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.41976e-10 2.173724e-10 1.743633e-10 ] [ 1.73064e-10 2.628356e-10 3.804992e-10 ] [ 2.229685e-10 4.150034e-10 1.946802e-10 ] [ 3.641834e-10 1.485515e-10 2.800746e-10 ] [ 4.113003e-10 2.080099e-10 4.963049e-10 ] [ 4.173975000000001e-10 3.620344e-10 3.169433e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9436864 -3.9478575 -5.5427662 ] [ -9.5210554 -0.7429088 9.0675065 ] [ -0.4782992 8.7501121 -4.067679 ] [ 4.806088 -9.7636918 -3.8021775 ] [ 2.3828217 -1.554881 6.3083389 ] [ 6.7541314 7.259227 -1.9632226 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.318482149846917e-09 -6.325164988749937e-09 -8.880490420200459e-09 ] [ -1.525441236722159e-08 -1.190271110746583e-09 1.452774692325204e-08 ] [ -7.663197959873434e-10 1.401922503599919e-08 -6.517140194719123e-09 ] [ 7.70020183110743e-09 -1.564315873465667e-08 -6.091759898631792e-09 ] [ 3.817701219274912e-09 -2.491193986326125e-09 1.010707310166319e-08 ] [ 1.082131142289117e-08 1.163056378448012e-08 -3.14542935114619e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.348339 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.160277222712851e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5678397 2.170246 2.0507382 ] [ 1.4196294 2.3824965 4.4657244 ] [ 2.6363963 4.2335354 1.6519445 ] [ 3.5823363 0.8717063 2.4441291 ] [ 3.8426088 2.2147909 4.4510044 ] [ 4.2600865 4.2652968 3.3651144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5678397e-10 2.170246e-10 2.0507382e-10 ] [ 1.4196294e-10 2.3824965e-10 4.4657244e-10 ] [ 2.6363963e-10 4.2335354e-10 1.6519445e-10 ] [ 3.5823363e-10 8.717063000000001e-11 2.4441291e-10 ] [ 3.8426088e-10 2.2147909e-10 4.4510044e-10 ] [ 4.2600865e-10 4.2652968e-10 3.3651144e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 5.5e-06 2.22e-05 ] [ 4.03e-05 3.3e-06 -3.48e-05 ] [ 8.1e-06 -1.23e-05 -8.1e-06 ] [ -2.04e-05 4.9e-06 1.92e-05 ] [ 2e-07 -3.9e-06 -2.66e-05 ] [ -2.76e-05 2.4e-06 2.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 8.8119714144e-15 3.556832098176e-14 ] [ 6.456771781824e-14 5.28718284864e-15 -5.575574640383999e-14 ] [ 1.297763062848e-14 -1.970677243584e-14 -1.297763062848e-14 ] [ -3.268440306432e-14 7.850665441919999e-15 3.076179111936e-14 ] [ 3.2043532416e-16 -6.24848882112e-15 -4.261789811328e-14 ] [ -4.422007473408001e-14 3.84522388992e-15 4.502116304448e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }