{ "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" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2878274 0.0753622 -0.2631052 ] [ 0.5804532 4.6034946 0.7282549 ] [ -1.9330488 -3.9803858 -0.6581292 ] [ 1.6118021 -0.6916363 -5.1085149 ] [ 0.028621 -0.0068347 5.3014944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.6115033110565e-10 1.207435549320538e-10 -4.215410002509082e-10 ] [ 9.299885465085466e-10 7.375611422099049e-09 1.166792974763042e-09 ] [ -3.097085594225495e-09 -6.377281070524305e-09 -1.054439217705807e-09 ] [ 2.582391641976344e-09 -1.108123509956615e-09 -8.18474313978845e-09 ] [ 4.58558970639168e-11 -1.095039655018176e-11 8.493930382982125e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.5492303992349505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.686493967486889e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3345674 1.7817918 2.0709295 ] [ 1.839711 5.0572911 1.7395514 ] [ 0.856339 3.124219 0.8241247 ] [ 3.1910866 3.4581113 0.6379122 ] [ 3.3179371 3.7148628 2.986358 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3345674e-10 1.7817918e-10 2.0709295e-10 ] [ 1.839711e-10 5.057291099999999e-10 1.7395514e-10 ] [ 8.56339e-11 3.124219e-10 8.241247000000001e-11 ] [ 3.1910866e-10 3.4581113e-10 6.379122e-11 ] [ 3.3179371e-10 3.714862800000001e-10 2.986358e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 1.39e-05 -6.9e-06 ] [ -2.2e-06 -1.45e-05 3.5e-06 ] [ 8.9e-06 5.4e-06 7.5e-06 ] [ 1.4e-06 -7.8e-06 6.6e-06 ] [ -6e-06 3e-06 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.36457090368e-15 2.227025502912e-14 -1.105501868352e-14 ] [ -3.52478856576e-15 -2.32315610016e-14 5.6076181728e-15 ] [ 1.425937192512e-14 8.65175375232e-15 1.2016324656e-14 ] [ 2.24304726912e-15 -1.249697764224e-14 1.057436569728e-14 ] [ -9.6130597248e-15 4.8065298624e-15 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }