{ "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" [ [ 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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2056184 -0.1887138 -0.8136309 ] [ -3.2044367 -0.7085232 2.2320252 ] [ -0.4562113 -0.1417328 0.6341675 ] [ 0.1984105 0.5833962 -0.8423642 ] [ 4.3954666 -2.7579425 -2.3530439 ] [ -0.0629423 3.4067093 1.8337928 ] [ 0.3353316 -0.1931931 -0.6909465 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.931613630000466e-09 -3.023528408733492e-10 -1.303580416680391e-09 ] [ -5.134073605872067e-09 -1.135179315686909e-09 3.576098621939176e-09 ] [ -7.309310850267641e-10 -2.270809804313952e-10 1.016048350542195e-09 ] [ 3.178886670402569e-10 9.347037600043908e-10 -1.349616238558103e-09 ] [ 7.042313882047423e-09 -4.418711031415544e-09 -3.769991955356232e-09 ] [ -1.008446823502182e-10 5.458150039290496e-09 2.938059975757434e-09 ] [ 5.372604541618344e-10 -3.095294706700254e-10 -1.107018337644081e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.297304 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.251986620199474e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8939998 2.6035089 2.8514675 ] [ 2.5706659 0.9031561 5.6089383 ] [ 2.0526819 0.2098562 3.362489 ] [ 3.7458147 1.1694755 1.8132315 ] [ 4.4655988 0.6535026 4.1004948 ] [ 3.5748964 2.9508817 4.7270169 ] [ 4.1234495 3.4730214 2.401955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8939998e-10 2.6035089e-10 2.8514675e-10 ] [ 2.5706659e-10 9.031561e-11 5.6089383e-10 ] [ 2.0526819e-10 2.098562e-11 3.362489e-10 ] [ 3.7458147e-10 1.1694755e-10 1.8132315e-10 ] [ 4.4655988e-10 6.535026000000001e-11 4.1004948e-10 ] [ 3.5748964e-10 2.9508817e-10 4.7270169e-10 ] [ 4.123449500000001e-10 3.4730214e-10 2.401955e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.68e-05 -2.67e-05 1.1e-05 ] [ -2.98e-05 1.96e-05 8.3e-06 ] [ -1.8e-06 8e-07 -3.1e-05 ] [ 7e-07 3.9e-05 4.89e-05 ] [ 9.4e-06 -2.32e-05 -8.8e-06 ] [ 3.26e-05 -7e-07 -9.3e-06 ] [ -4.79e-05 -8.8e-06 -1.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.896010013119999e-14 -4.277811612779999e-14 1.7623942974e-14 ] [ -4.77448636932e-14 3.140266202639999e-14 1.32980660622e-14 ] [ -2.8839179412e-15 1.2817413072e-15 -4.966747565399999e-14 ] [ 1.1215236438e-15 6.248488872599999e-14 7.834643740259999e-14 ] [ 1.50604603596e-14 -3.71704979088e-14 -1.40991543792e-14 ] [ 5.22309582684e-14 -1.1215236438e-15 -1.49002426962e-14 ] [ -7.674426076859999e-14 -1.40991543792e-14 -3.02811383826e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.361976 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.422565880326878e-18 } }