{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1587503 -1.8655181 -9.573344 ] [ -2.9561616 0.9097584 7.027021 ] [ -0.5357296 -4.8196721 0.6291657 ] [ -2.0862997 5.9093237 -0.7180039 ] [ 8.7369413 -0.1338919 2.6351612 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.060875881604985e-09 -2.988889485499237e-09 -1.533818793967596e-08 ] [ -4.736293002826722e-09 1.457593639056415e-09 1.125852876007064e-08 ] [ -8.583334401905357e-10 -7.72196595854204e-09 1.008034575149267e-09 ] [ -3.342620603322054e-09 9.467780276879354e-09 -1.150369062223221e-09 ] [ 1.399812308816196e-08 -2.145184718944915e-10 4.221993666679273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1050039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.372588035272821e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7338677 2.4646775 -0.2309414 ] [ 2.6804114 3.9863732 3.0909475 ] [ 3.2141205 1.0092014 0.8330677 ] [ 1.4039772 4.3046447 1.1645314 ] [ 3.7987402 1.9494331 2.886315 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7338677e-10 2.4646775e-10 -2.309414e-11 ] [ 2.6804114e-10 3.9863732e-10 3.0909475e-10 ] [ 3.2141205e-10 1.0092014e-10 8.330677e-11 ] [ 1.4039772e-10 4.3046447e-10 1.1645314e-10 ] [ 3.7987402e-10 1.9494331e-10 2.886315e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.54e-05 -2.01e-05 1.55e-05 ] [ -1.23e-05 -1.24e-05 -2e-06 ] [ -3.38e-05 1.9e-06 -2.94e-05 ] [ 8.1e-06 6.5e-06 5.7e-06 ] [ 1.26e-05 2.42e-05 1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.069528616832e-14 -3.220375007808e-14 2.48337376224e-14 ] [ -1.970677243584e-14 -1.986699009792e-14 -3.2043532416e-15 ] [ -5.415356978304e-14 3.04413557952e-15 -4.710399265152e-14 ] [ 1.297763062848e-14 1.04141480352e-14 9.13240673856e-15 ] [ 2.018742542208e-14 3.877267422336e-14 1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }