{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0096243e-10 1.6919016e-10 1.590077e-10 ] [ 4.002146200000001e-10 1.1217157e-10 2.759264e-10 ] [ 3.2281834e-10 3.3719537e-10 2.7543409e-10 ] ] "source-value" [ [ 2.0096243 1.6919016 1.590077 ] [ 4.0021462 1.1217157 2.759264 ] [ 3.2281834 3.3719537 2.7543409 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.85443786761728e-12 2.731711138464e-13 -1.7952389036064e-12 ] [ 3.12152071030464e-12 -2.44908718255488e-12 1.48714033942656e-12 ] [ -2.670828426873601e-13 2.17591606870848e-12 3.0825878184192e-13 ] ] "source-value" [ [ -0.0017816 0.0001705 -0.0011205 ] [ 0.0019483 -0.0015286 0.0009282 ] [ -0.0001667 0.0013581 0.0001924 ] ] } "species" { "source-value" [ "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" -1.051419339080326e-18 "source-value" -6.5624434 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.698664002612731e-09 -1.665570584025842e-09 1.385735697178211e-09 ] [ -4.234043476826648e-09 3.625214278093041e-09 -1.950042330231731e-09 ] [ 1.535379474213917e-09 -1.959643533849537e-09 5.643066330535199e-10 ] ] "source-value" [ [ 1.6843736 -1.0395674 0.8649082 ] [ -2.6426821 2.2626808 -1.2171207 ] [ 0.9583085 -1.2231133 0.3522125 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.424604981519697e-19 "source-value" -5.8823758 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.910276e-10 1.798687e-10 1.549131e-10 ] [ 4.175786e-10 1.007669e-10 2.846903e-10 ] [ 3.153892e-10 3.379215e-10 2.707648e-10 ] ] "source-value" [ [ 1.910276 1.798687 1.549131 ] [ 4.175786 1.007669 2.846903 ] [ 3.153892 3.379215 2.707648 ] ] } "instance-id" 1 }