{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6074323 -20.3549121 -4.4038316 ] [ -18.2429319 10.5952264 -9.1963308 ] [ -16.7486634 9.1767654 8.869154 ] [ 21.7039615 -3.8140463 -4.7892868 ] [ 10.6802016 4.3969666 9.5202951 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.177567071378772e-09 -3.261216428505903e-08 -7.055716031460258e-09 ] [ -2.922839898502652e-08 1.697542403016295e-08 -1.473414620490296e-08 ] [ -2.683431692912864e-08 1.470279897844636e-08 1.42099511850748e-08 ] [ 3.47735796940433e-08 -6.110775812508742e-09 -7.673283341266045e-09 ] [ 1.711156930895075e-08 7.044717088958465e-09 1.52531942323368e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3132063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.910518294547272e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0198443 -0.354992 1.4209555 ] [ 0.4649827 2.6026768 0.183397 ] [ -0.0535184 1.6580932 2.4358563 ] [ 2.6008478 1.3529806 0.5166053 ] [ 2.3361595 2.2689734 2.8243233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0198443e-10 -3.54992e-11 1.4209555e-10 ] [ 4.649827e-11 2.6026768e-10 1.83397e-11 ] [ -5.35184e-12 1.6580932e-10 2.4358563e-10 ] [ 2.6008478e-10 1.3529806e-10 5.166053000000001e-11 ] [ 2.3361595e-10 2.2689734e-10 2.8243233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.23e-05 -3.31e-05 3.5e-05 ] [ 1.8e-06 5.4e-06 -3.75e-05 ] [ -3.97e-05 -3e-07 2.6e-05 ] [ 3.83e-05 5.4e-05 -3.08e-05 ] [ 2.2e-05 -2.6e-05 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.572853864384e-14 -5.303204614848e-14 5.6076181728e-14 ] [ 2.88391791744e-15 8.65175375232e-15 -6.008162327999999e-14 ] [ -6.360641184576e-14 -4.8065298624e-16 4.16565921408e-14 ] [ 6.136336457664001e-14 8.65175375232e-14 -4.934703992064001e-14 ] [ 3.52478856576e-14 -4.16565921408e-14 1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }