{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9022565 -10.1575853 1.1847046 ] [ -36.9914004 41.783982 -0.4111989 ] [ -10.2747454 6.6409249 14.0335544 ] [ 27.996761 -39.7224278 -32.9232614 ] [ 28.1716412 1.4551062 18.1162014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.426298735417462e-08 -1.627424582552188e-08 1.898106028312316e-09 ] [ -5.926675737981825e-08 6.694531963587658e-08 -6.588132695065025e-10 ] [ -1.646195700017898e-08 1.063993470292879e-08 2.248423295164789e-08 ] [ 4.485575630188247e-08 -6.364234566691202e-08 -5.274888013015412e-08 ] [ 4.513594527207171e-08 2.33133715362853e-09 2.902535457991809e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7190903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.75428631039605e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5020145 1.7711212 2.2570211 ] [ 2.7920834 4.2976224 1.0341677 ] [ 2.4911405 4.0426977 3.6918709 ] [ 4.2740703 2.1869455 0.2806997 ] [ 4.8536872 3.2757112 2.6676559 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5020145e-10 1.7711212e-10 2.2570211e-10 ] [ 2.7920834e-10 4.2976224e-10 1.0341677e-10 ] [ 2.4911405e-10 4.0426977e-10 3.6918709e-10 ] [ 4.2740703e-10 2.1869455e-10 2.806997e-11 ] [ 4.8536872e-10 3.2757112e-10 2.667655900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.8e-06 -2.78e-05 4.67e-05 ] [ 3.04e-05 3.38e-05 -1.93e-05 ] [ -4.11e-05 -3e-07 2.93e-05 ] [ 1.07e-05 -1.06e-05 -4.48e-05 ] [ 9.8e-06 4.9e-06 -1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.57013310132e-14 -4.454051042519999e-14 7.482164880779999e-14 ] [ 4.870616967359999e-14 5.415357022919999e-14 -3.09220090362e-14 ] [ -6.58494596574e-14 -4.806529901999999e-16 4.69437753762e-14 ] [ 1.71432899838e-14 -1.69830723204e-14 -7.177751320319999e-14 ] [ 1.57013310132e-14 7.850665506599998e-15 -1.90659019446e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.92185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.71117926740529e-18 } }