{ "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" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.788787 -35.2053833 -3.9543217 ] [ -53.2594428 14.9268289 -64.7957906 ] [ -23.3101751 24.9334997 45.0488442 ] [ 2.4772114 -8.2271527 -16.8082661 ] [ 27.0057981 -77.6911651 37.6602924 ] [ 56.8753954 81.2633725 2.8492419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.568336567739097e-08 -5.640524204956276e-08 -6.335521778862111e-09 ] [ -8.53310340909949e-08 2.391541628626178e-08 -1.038143008255724e-07 ] [ -3.73470175719743e-08 3.994787029406382e-08 7.217620497130168e-08 ] [ 3.968930189859237e-09 -1.31813517116916e-08 -2.69298109816052e-08 ] [ 4.326805834186506e-08 -1.244749683659329e-07 6.033844001577193e-08 ] [ 9.112442880863587e-08 1.301982755468617e-07 4.564988759183771e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 80.390544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.287998501301937e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2796043 0.3352334 3.1760274 ] [ 1.0226991 3.9180452 1.0502708 ] [ -0.0098788 2.1428488 3.5388133 ] [ 3.791166 0.7368215 0.73636 ] [ 3.4366736 -0.1279228 2.3517412 ] [ 2.8836833 3.8225523 0.9477862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.796043e-11 3.352334e-11 3.1760274e-10 ] [ 1.0226991e-10 3.9180452e-10 1.0502708e-10 ] [ -9.8788e-13 2.1428488e-10 3.538813300000001e-10 ] [ 3.791166e-10 7.368215e-11 7.363600000000001e-11 ] [ 3.4366736e-10 -1.279228e-11 2.3517412e-10 ] [ 2.8836833e-10 3.8225523e-10 9.477862e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.04e-05 -1.13e-05 -4.4e-06 ] [ -2.11e-05 4.75e-05 -1.08e-05 ] [ -8.6e-06 -1.57e-05 2.39e-05 ] [ -4.71e-05 -9.91e-05 0.0001974 ] [ 7.73e-05 4.83e-05 -0.0001678 ] [ 1.98e-05 3.04e-05 -3.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.268440306432e-14 -1.810459581504e-14 -7.04957713152e-15 ] [ -3.380592669888e-14 7.610338948800001e-14 -1.730350750464e-14 ] [ -1.377871893888e-14 -2.515417294656e-14 3.829202123712e-14 ] [ -7.546251883968001e-14 -1.5877570312128e-13 3.1626966494592e-13 ] [ 1.2384825278784e-13 7.738513078464e-14 -2.6884523697024e-13 ] [ 3.172309709184e-14 4.870616927232e-14 -6.136336457664001e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.352435 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.183431498295165e-18 } }