{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8447925 3.1254272 -7.5570181 ] [ -30.6031613 -6.1338631 51.0656252 ] [ 39.3038872 -15.9224863 -31.2239252 ] [ 2.7236148 19.161687 -11.1960899 ] [ -0.5795482 -0.2307647 -1.088592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.737527300092719e-08 5.007486389852406e-09 -1.210767772278244e-08 ] [ -4.903166955743134e-08 -9.827532054007813e-09 8.181615082197533e-08 ] [ 6.297176917840037e-08 -2.551063529486829e-08 -5.002624296504797e-08 ] [ 4.363711956624868e-09 3.070040692648729e-08 -1.793811348215501e-08 ] [ -9.285385766667226e-10 -3.697258072459257e-10 -1.744116651989914e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.990042 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.994928629210073e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8800164 1.8792531 0.0471052 ] [ 0.9770164 1.4703014 2.7260635 ] [ 3.1579933 1.0662148 1.2129658 ] [ 2.1076084 3.6530496 1.6458729 ] [ 4.6563316 3.172774 1.4803004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.800164000000001e-11 1.8792531e-10 4.71052e-12 ] [ 9.770164e-11 1.4703014e-10 2.7260635e-10 ] [ 3.1579933e-10 1.0662148e-10 1.2129658e-10 ] [ 2.1076084e-10 3.6530496e-10 1.6458729e-10 ] [ 4.6563316e-10 3.172774e-10 1.4803004e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.15e-05 -2.4e-06 -3.81e-05 ] [ 3.28e-05 1.92e-05 2.81e-05 ] [ -2.9e-06 6.67e-05 2e-06 ] [ 4e-05 -3.54e-05 1.36e-05 ] [ -0.0001014 -4.81e-05 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.04685635552e-14 -3.84522388992e-15 -6.104292925248e-14 ] [ 5.255139316223999e-14 3.076179111936e-14 4.502116304448e-14 ] [ -4.646312200320001e-15 1.0686518060736e-13 3.2043532416e-15 ] [ 6.4087064832e-14 -5.671705237632e-14 2.178960204288e-14 ] [ -1.6246070934912e-13 -7.706469546047999e-14 -8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.624493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663537401725326e-18 } }