{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -8.397718e-11 4.443858600000001e-10 1.7890644e-10 ] [ 1.3344793e-10 -6.723416000000001e-11 9.4494303e-10 ] [ -5.065702e-11 -2.8753169e-10 2.6833463e-10 ] [ 4.681549000000001e-10 -3.772648000000001e-11 -1.8845419e-10 ] [ 7.352615100000001e-10 -7.882155e-11 5.0022221e-10 ] [ 4.019117900000001e-10 5.8500317e-10 7.3821166e-10 ] [ 6.3856877e-10 6.3826509e-10 4.439552e-11 ] ] "source-value" [ [ -0.8397718 4.4438586 1.7890644 ] [ 1.3344793 -0.6723416 9.4494303 ] [ -0.5065702 -2.8753169 2.6833463 ] [ 4.681549 -0.3772648 -1.8845419 ] [ 7.3526151 -0.7882155 5.0022221 ] [ 4.0191179 5.8500317 7.3821166 ] [ 6.3856877 6.3826509 0.4439552 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ -1.6021766208e-16 -4.8065298624e-16 6.408706483200001e-16 ] [ -4.8065298624e-16 -3.2043532416e-16 0.0 ] [ 1.6021766208e-16 -3.2043532416e-16 -4.8065298624e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 6.408706483200001e-16 4.8065298624e-16 ] [ 3.2043532416e-16 4.8065298624e-16 -4.8065298624e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -1e-07 -3e-07 4e-07 ] [ -3e-07 -2e-07 -0.0 ] [ 1e-07 -2e-07 -3e-07 ] [ 0.0 0.0 0.0 ] [ 0.0 4e-07 3e-07 ] [ 2e-07 3e-07 -3e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.213611198479468e-31 "source-value" 3.8782311e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.205832651720258e-08 6.906546658921971e-09 -4.721375777181101e-09 ] [ -4.309517851773322e-09 -4.461848799437434e-09 1.326362652530526e-08 ] [ -9.807166306327837e-09 -1.044933615966964e-08 -2.168527631221661e-09 ] [ 4.641195008410827e-09 -5.293957332045729e-09 -1.272632329745402e-08 ] [ 1.247760460319427e-08 -7.769660353278325e-09 2.948225601992684e-09 ] [ 2.005321429090882e-09 1.062391829646109e-08 9.50409393042511e-09 ] [ 7.05088963460776e-09 1.044433752883041e-08 -6.099719191648603e-09 ] ] "source-value" [ [ -7.5262155 4.3107274 -2.946851 ] [ -2.6897895 -2.784867 8.2785046 ] [ -6.1211518 -6.5219627 -1.3534885 ] [ 2.8968061 -3.3042283 -7.9431463 ] [ 7.7879083 -4.8494406 1.8401377 ] [ 1.2516232 6.6309283 5.9319889 ] [ 4.4008192 6.5188428 -3.8071453 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.97864472673819e-18 "source-value" 56.040293 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] "source-value" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] } "instance-id" 1 }