{ "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" [ [ 2.009011 2.631584 2.068402 ] [ 2.205606 1.805457 4.240805 ] [ 0.8880067 3.587298 3.588265 ] [ 4.034619 2.466924 2.718393 ] [ 3.26703 4.599532 3.000235 ] [ 4.036538 3.227395 4.622039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.009011e-10 2.631584e-10 2.068402e-10 ] [ 2.205606e-10 1.805457e-10 4.240805e-10 ] [ 8.880067e-11 3.587298e-10 3.588265e-10 ] [ 4.034619000000001e-10 2.466924e-10 2.718393e-10 ] [ 3.26703e-10 4.599532e-10 3.000235e-10 ] [ 4.036538e-10 3.227395e-10 4.622039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1026529 -1.7193981 -7.3824115 ] [ -2.5483481 -5.5025125 5.8701778 ] [ -3.0634 2.8914557 2.1867375 ] [ 7.8258597 -5.7705058 -6.0085314 ] [ -0.6371781 8.9980368 -1.1052252 ] [ 1.5257194 1.1029239 6.4392527 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.970997979792338e-09 -2.754779460363995e-09 -1.182792720787289e-08 ] [ -4.082903781118296e-09 -8.815996955792924e-09 9.405061708585523e-09 ] [ -4.908107900595599e-09 4.632622760786113e-09 3.503539727191574e-09 ] [ 1.253840955230225e-08 -9.245369559121475e-09 -9.626728613735306e-09 ] [ -1.020871863516515e-09 1.441644431283213e-08 -1.770765990747977e-09 ] [ 2.444471972720499e-09 1.767078901660152e-09 1.031682021636141e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.25748505564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.963865614775479e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.939367 2.7763247 2.0048353 ] [ 2.3000914 1.6525084 4.0322885 ] [ 1.0095539 3.598426 3.9832356 ] [ 4.1241487 2.4644146 2.8005112 ] [ 3.3066885 4.6208984 2.4319931 ] [ 3.7609612 3.205618 4.9852753 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.939367e-10 2.7763247e-10 2.0048353e-10 ] [ 2.3000914e-10 1.6525084e-10 4.0322885e-10 ] [ 1.0095539e-10 3.598426e-10 3.9832356e-10 ] [ 4.1241487e-10 2.4644146e-10 2.8005112e-10 ] [ 3.3066885e-10 4.6208984e-10 2.4319931e-10 ] [ 3.7609612e-10 3.205618e-10 4.9852753e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -2e-07 -6.93e-05 ] [ -4.41e-05 -4.62e-05 4.07e-05 ] [ -3.55e-05 8.2e-06 3.38e-05 ] [ 5.29e-05 -3.18e-05 -2.63e-05 ] [ -3.9e-06 5.23e-05 -1.91e-05 ] [ 3.09e-05 1.77e-05 4.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.806529901999999e-16 -3.204353268e-16 -1.110308407362e-13 ] [ -7.06559895594e-14 -7.40205604908e-14 6.520858900379999e-14 ] [ -5.6877270507e-14 1.31378483988e-14 5.415357022919999e-14 ] [ 8.475514393859999e-14 -5.09492169612e-14 -4.21372454742e-14 ] [ -6.248488872599999e-15 8.379383795819998e-14 -3.06015737094e-14 ] [ 4.950725799059999e-14 2.83585264218e-14 6.42472830234e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.38214005564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.464490537806606e-18 } }