{ "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" [ [ 2.635738 2.275834 0.8013506 ] [ 2.939619 0.762978 3.027642 ] [ 4.571028 2.353947 2.00113 ] [ 3.548969 3.060298 4.401477 ] [ 3.268552 4.224197 2.762666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.635738e-10 2.275834e-10 8.013506000000001e-11 ] [ 2.939619e-10 7.629780000000001e-11 3.027642e-10 ] [ 4.571028e-10 2.353947e-10 2.00113e-10 ] [ 3.548969e-10 3.060298e-10 4.401477e-10 ] [ 3.268552e-10 4.224197e-10 2.762666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9281136 0.6304213 1.1904166 ] [ 0.4784659 2.9499783 0.8251478 ] [ 2.6065508 -1.2133986 -0.1755981 ] [ -0.4448149 -4.4763614 1.7352678 ] [ -1.7120882 2.1093604 -3.5752341 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.487001923617622e-09 1.010046276435904e-09 1.907257661245724e-09 ] [ 7.665868851457805e-10 4.726386303067042e-09 1.322032524756505e-09 ] [ 4.176154787094006e-09 -1.944078884648312e-09 -2.813391727947954e-10 ] [ -7.126720392350466e-10 -7.171921640419527e-09 2.780205522892585e-09 ] [ -2.743067709387118e-09 3.379567945564893e-09 -5.728156536100019e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.822413 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.054377050009784e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4915845 2.3563233 1.0272973 ] [ 2.9005844 0.8256963 2.9842683 ] [ 4.8353192 2.3581508 2.158701 ] [ 3.5726997 2.8032302 4.3904877 ] [ 3.1637182 4.3338534 2.4335113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4915845e-10 2.3563233e-10 1.0272973e-10 ] [ 2.9005844e-10 8.256963000000001e-11 2.9842683e-10 ] [ 4.8353192e-10 2.3581508e-10 2.158701e-10 ] [ 3.5726997e-10 2.8032302e-10 4.390487700000001e-10 ] [ 3.1637182e-10 4.3338534e-10 2.4335113e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.03e-05 -1.8e-05 -3.33e-05 ] [ 2.8e-06 -3.9e-06 -2.6e-06 ] [ 1.43e-05 -1.39e-05 5.3e-06 ] [ 8.6e-06 -2.4e-06 2.75e-05 ] [ -5.4e-06 3.82e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.252418567019999e-14 -2.8839179412e-14 -5.33524819122e-14 ] [ 4.486094575199999e-15 -6.248488872599999e-15 -4.165659248399999e-15 ] [ 2.29111258662e-14 -2.22702552126e-14 8.4915361602e-15 ] [ 1.37787190524e-14 -3.845223921599999e-15 4.4059857435e-14 ] [ -8.6517538236e-15 6.12031474188e-14 4.9667475654e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.126158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423477690979217e-18 } }