{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6584282 -3.4161254 -1.5013785 ] [ -4.8713764 -0.8842302 4.641797 ] [ -5.7909446 1.1453738 -2.7653555 ] [ 0.1019717 5.6397121 2.3111699 ] [ 2.4793379 -3.9780128 -7.2561985 ] [ 6.0370509 -2.5532934 5.4055171 ] [ 6.7023885 4.0465759 -0.8355515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.463624813206679e-09 -5.473236294693903e-09 -2.405473551489969e-09 ] [ -7.804805443499036e-09 -1.416692965517147e-09 7.436978693171298e-09 ] [ -9.278116126908476e-09 1.835091139555789e-09 -4.430587966803387e-09 ] [ 1.633766750692578e-10 9.035814949107069e-09 3.702902410984116e-09 ] [ 3.972337251170628e-09 -6.373479157912915e-09 -1.162571168836585e-08 ] [ 9.67242189024867e-09 -4.090827025226415e-09 8.66059319230744e-09 ] [ 1.073841024669031e-08 6.483329354687519e-09 -1.338701089803651e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.670569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.869831295728474e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4815202 1.4574316 2.6923719 ] [ 2.10294 2.0495606 4.9413232 ] [ 2.2556814 3.6912864 1.7917765 ] [ 2.9245653 4.3287301 4.2127373 ] [ 3.8854992 1.5387247 1.9082817 ] [ 4.5544339 2.1761967 4.3292178 ] [ 4.805413 3.9585118 2.4037487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4815202e-10 1.4574316e-10 2.6923719e-10 ] [ 2.10294e-10 2.0495606e-10 4.9413232e-10 ] [ 2.2556814e-10 3.6912864e-10 1.7917765e-10 ] [ 2.9245653e-10 4.3287301e-10 4.2127373e-10 ] [ 3.8854992e-10 1.5387247e-10 1.9082817e-10 ] [ 4.5544339e-10 2.1761967e-10 4.329217800000001e-10 ] [ 4.805413e-10 3.9585118e-10 2.4037487e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.84e-05 -4.32e-05 8.8e-06 ] [ -1.67e-05 2.97e-05 3.22e-05 ] [ -3.7e-05 7.92e-05 3.37e-05 ] [ 2.69e-05 -2.28e-05 -4.61e-05 ] [ 7.5e-05 -1.37e-05 3e-07 ] [ -5.28e-05 -6.7e-06 -4.34e-05 ] [ -1.36e-05 -2.25e-05 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.94800500656e-14 -6.92140305888e-14 1.40991543792e-14 ] [ -2.67563497878e-14 4.75846460298e-14 5.159008761479998e-14 ] [ -5.9280535458e-14 1.268923894128e-13 5.399335256579999e-14 ] [ 4.309855145459999e-14 -3.65296272552e-14 -7.386034282739999e-14 ] [ 1.2016324755e-13 -2.19498198858e-14 4.806529901999999e-16 ] [ -8.45949262752e-14 -1.07345834478e-14 -6.953446591559999e-14 ] [ -2.17896022224e-14 -3.6048974265e-14 2.33917788564e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.023701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.727497596640243e-18 } }