{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4057229 -1.5542276 -7.8765435 ] [ -9.2318741 -4.02968 9.2020601 ] [ -4.1386734 9.1033756 -3.1341022 ] [ 1.4650904 -7.4532327 -4.5413817 ] [ 9.5119137 3.42609 -7.7880844 ] [ 4.9954287 -4.3757604 5.2594253 ] [ 2.8038376 4.883435 8.8786265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.660922848903177e-09 -2.490147124122094e-09 -1.261961384841421e-08 ] [ -1.479109284918904e-08 -6.456259085305344e-09 1.474332555541651e-08 ] [ -6.630885762606846e-09 1.458521555668117e-08 -5.021385272037846e-09 ] [ 2.34733358623852e-09 -1.194139518132206e-08 -7.276095585868959e-09 ] [ 1.523976574920722e-08 5.489201298756672e-09 -1.247788674649719e-08 ] [ 8.003559074013337e-09 -7.010741011102456e-09 8.426528254504028e-09 ] [ 4.492243051239982e-09 7.82412538619645e-09 1.422512780311533e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.605658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.699213729580049e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5867358 1.9211849 1.933154 ] [ 1.783666 1.4593475 4.2764007 ] [ 2.9359055 3.9230865 2.1648426 ] [ 3.5401488 0.5937787 1.5268843 ] [ 4.9425174 2.6746166 1.7677158 ] [ 4.4111037 1.2535922 3.9476434 ] [ 3.1860078 3.5402099 4.5172311 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5867358e-10 1.9211849e-10 1.933154e-10 ] [ 1.783666e-10 1.4593475e-10 4.2764007e-10 ] [ 2.9359055e-10 3.9230865e-10 2.1648426e-10 ] [ 3.5401488e-10 5.937787e-11 1.5268843e-10 ] [ 4.9425174e-10 2.6746166e-10 1.7677158e-10 ] [ 4.4111037e-10 1.2535922e-10 3.9476434e-10 ] [ 3.1860078e-10 3.5402099e-10 4.5172311e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 -1.32e-05 1.16e-05 ] [ 8.4e-06 4.3e-05 5.9e-06 ] [ 5.1e-06 -1.66e-05 4.1e-06 ] [ 8.9e-06 3.52e-05 -2.5e-06 ] [ -9.5e-06 -1.51e-05 1.2e-06 ] [ -4e-07 1.2e-06 -9.3e-06 ] [ -2.17e-05 -3.46e-05 -1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474002491136e-14 -2.114873139456e-14 1.858524880128e-14 ] [ 1.345828361472e-14 6.889359469439999e-14 9.45284206272e-15 ] [ 8.17110076608e-15 -2.659613190528e-14 6.568924145279999e-15 ] [ 1.425937192512e-14 5.639661705216e-14 -4.005441552e-15 ] [ -1.52206778976e-14 -2.419286697408e-14 1.92261194496e-15 ] [ -6.408706483200001e-16 1.92261194496e-15 -1.490024257344e-14 ] [ -3.476723267136e-14 -5.543531107968001e-14 -1.746372516672e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.968507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.039089844688114e-18 } }