{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.700341 1.969723 2.203994 ] [ 1.820171 2.226461 4.644887 ] [ 1.683397 4.142957 3.874532 ] [ 4.686676 2.237231 1.35428 ] [ 4.257123 2.593073 3.820407 ] [ 3.357584 4.187851 2.029918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700341e-10 1.969723e-10 2.203994e-10 ] [ 1.820171e-10 2.226461e-10 4.644887e-10 ] [ 1.683397e-10 4.142957e-10 3.874532e-10 ] [ 4.686676000000001e-10 2.237231e-10 1.35428e-10 ] [ 4.257123e-10 2.593073e-10 3.820407e-10 ] [ 3.357584e-10 4.187851e-10 2.029918e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9439126 -3.3575221 0.3668044 ] [ 0.342904 -2.450665 1.0854935 ] [ 1.5891774 1.1128661 -2.4574977 ] [ 5.6943315 -2.2251697 -4.7269036 ] [ 1.0425203 0.8167711 5.2435288 ] [ -1.7250207 6.1037197 0.4885747 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.112537451625819e-08 -5.379343456758612e-09 5.876854389283895e-10 ] [ 5.493927765051358e-10 -3.926398200761609e-09 1.739152322058879e-09 ] [ 2.546142897560872e-09 1.783008062190707e-09 -3.937345393048741e-09 ] [ 9.123324875550168e-09 -3.565114900024789e-09 -7.573334499090482e-09 ] [ 1.67030166513067e-09 1.308611571746477e-09 8.401059323066058e-09 ] [ -2.763787858706323e-09 9.77923708382549e-09 7.827829683035596e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.190589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.754236002049742e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2906658 2.1048303 2.2132376 ] [ 1.993335 1.7619232 4.7269541 ] [ 1.8711749 4.1204557 3.7273267 ] [ 4.7512484 2.1298709 1.5279161 ] [ 4.1139692 2.904464 3.8770923 ] [ 3.4848987 4.3357518 1.8554911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2906658e-10 2.1048303e-10 2.2132376e-10 ] [ 1.993335e-10 1.7619232e-10 4.726954100000001e-10 ] [ 1.8711749e-10 4.1204557e-10 3.7273267e-10 ] [ 4.7512484e-10 2.1298709e-10 1.5279161e-10 ] [ 4.1139692e-10 2.904464e-10 3.8770923e-10 ] [ 3.4848987e-10 4.3357518e-10 1.8554911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-05 -5.97e-05 -2.06e-05 ] [ -6e-07 -8.7e-06 -5.4e-06 ] [ -1.93e-05 4.38e-05 9.3e-06 ] [ 3.5e-06 -1.18e-05 -1.39e-05 ] [ 4e-05 -1.41e-05 5.41e-05 ] [ -1.7e-06 5.06e-05 -2.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5247885948e-14 -9.56499450498e-14 -3.300483866039999e-14 ] [ -9.613059803999998e-16 -1.39389367158e-14 -8.6517538236e-15 ] [ -3.09220090362e-14 7.01753365692e-14 1.49002426962e-14 ] [ 5.607618218999999e-15 -1.89056842812e-14 -2.22702552126e-14 ] [ 6.408706535999999e-14 -2.25906905394e-14 8.66777558994e-14 ] [ -2.7237002778e-15 8.107013768039999e-14 -3.78113685624e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.607709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.30171898400715e-18 } }