{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8613291 -8.037508 -4.4484648 ] [ -13.7528396 1.8978116 11.6648389 ] [ 3.1891325 4.8062935 -18.4071604 ] [ 12.3610865 -10.0382621 7.5053117 ] [ 4.0639498 11.3716649 3.6854747 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.390884450834705e-09 -1.287750740709297e-08 -7.127226301011748e-09 ] [ -2.203447807673242e-08 3.040629376203041e-09 1.868913217097839e-08 ] [ 5.109553532133455e-09 7.700531078403004e-09 -2.949152204819558e-08 ] [ 1.98046437979865e-08 -1.608306885008271e-08 1.20248349375567e-08 ] [ 6.511165357664836e-09 1.821941564235197e-08 5.904781400889894e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.8856399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.62330478382765e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7596168 0.8080331 0.9718976 ] [ 1.96443 2.5134613 2.4840095 ] [ 3.5900637 2.7341168 -0.2230423 ] [ 4.79908 1.1293257 2.2228033 ] [ 4.1427115 3.4432685 2.0172723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7596168e-10 8.080330999999999e-11 9.718976e-11 ] [ 1.96443e-10 2.5134613e-10 2.4840095e-10 ] [ 3.5900637e-10 2.7341168e-10 -2.230423e-11 ] [ 4.79908e-10 1.1293257e-10 2.2228033e-10 ] [ 4.1427115e-10 3.4432685e-10 2.0172723e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.25e-05 -7.08e-05 -1.02e-05 ] [ -3.67e-05 3.27e-05 -2.52e-05 ] [ -5.65e-05 3.51e-05 -8.5e-06 ] [ 8.7e-06 -1.92e-05 2.14e-05 ] [ 6.2e-05 2.23e-05 2.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.604897396800001e-14 -1.1343410475264e-13 -1.634220153216e-14 ] [ -5.879988198335999e-14 5.239117550016001e-14 -4.037485084416e-14 ] [ -9.052297907519999e-14 5.623639939008e-14 -1.36185012768e-14 ] [ 1.393893660096e-14 -3.076179111936e-14 3.428657968511999e-14 ] [ 9.93349504896e-14 3.572853864384e-14 3.604897396800001e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }