{ "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" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8810032 -4.9673743 1.8947118 ] [ -0.5965261 -1.1901197 1.5350153 ] [ -4.80027 0.8137725 -3.4384592 ] [ -3.7034064 8.6799121 3.0899852 ] [ 7.2789474 -1.0888316 -9.0769005 ] [ 3.7022582 -2.247359 5.9956475 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.013699350689986e-09 -7.958610970222766e-09 3.035662949113886e-09 ] [ -9.557401711170028e-10 -1.90678195929351e-09 2.459365626230298e-09 ] [ -7.690880367527616e-09 1.303807274149968e-09 -5.509018941814672e-09 ] [ -5.933511151401093e-09 1.390675223721903e-08 4.950702046058012e-09 ] [ 1.166215934831294e-08 -1.744500533508257e-09 -1.454279777042783e-08 ] [ 5.931671532205091e-09 -3.600666048344467e-09 9.606086251057968e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.219552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.598658701424988e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9356207 1.5077567 3.0616254 ] [ 1.7593831 2.6804471 5.2872993 ] [ 1.2569584 3.1938557 1.3133639 ] [ 2.1388808 4.3066852 3.3975234 ] [ 3.6907128 2.9653165 1.7448088 ] [ 4.0049222 2.6442738 4.2300552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9356207e-10 1.5077567e-10 3.0616254e-10 ] [ 1.7593831e-10 2.6804471e-10 5.2872993e-10 ] [ 1.2569584e-10 3.1938557e-10 1.3133639e-10 ] [ 2.1388808e-10 4.3066852e-10 3.3975234e-10 ] [ 3.6907128e-10 2.9653165e-10 1.7448088e-10 ] [ 4.0049222e-10 2.6442738e-10 4.2300552e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.8e-06 -2.76e-05 -2.45e-05 ] [ -2.08e-05 2.14e-05 1.54e-05 ] [ 1.08e-05 -2.24e-05 1.81e-05 ] [ 2.7e-06 2.55e-05 -8.3e-06 ] [ -9.8e-06 2.77e-05 1.71e-05 ] [ 2.38e-05 -2.46e-05 -1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089480102144e-14 -4.422007473408001e-14 -3.92533272096e-14 ] [ -3.332527371264e-14 3.428657968511999e-14 2.467351996032e-14 ] [ 1.730350750464e-14 -3.588875630592e-14 2.899939683648e-14 ] [ 4.32587687616e-15 4.08555038304e-14 -1.329806595264e-14 ] [ -1.570133088384e-14 4.438029239616e-14 2.739722021568e-14 ] [ 3.813180357504e-14 -3.941354487168e-14 -2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }