{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.4412384 -15.8398167 -36.933306 ] [ -16.6493513 14.4267909 32.6892835 ] [ -1.0207239 2.3529596 1.3713797 ] [ -0.1511317 -0.4959266 -0.2913354 ] [ 8.3799685 -0.4440072 3.1639782 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.51265314358792e-08 -2.537818399449741e-08 -5.917367940205237e-08 ] [ -2.667520140434609e-08 2.311426709315019e-08 5.23740057744032e-08 ] [ -1.635379968871797e-09 3.76985686080692e-09 2.197192493579718e-09 ] [ -2.421396764017594e-10 -7.945620041528333e-10 -4.667707666914164e-10 ] [ 1.342618961374045e-08 -7.113779553068697e-10 5.069251900760866e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.67506514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.081573584825079e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.491121 2.2219398 -0.0954235 ] [ -0.3378264 3.0928467 1.9659006 ] [ 2.1625766 0.5858123 0.3787208 ] [ 2.4095176 0.4035367 2.7452546 ] [ 1.9751864 2.542518 1.785233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.91121e-11 2.2219398e-10 -9.54235e-12 ] [ -3.378264e-11 3.0928467e-10 1.9659006e-10 ] [ 2.1625766e-10 5.858122999999999e-11 3.787208000000001e-11 ] [ 2.4095176e-10 4.035367000000001e-11 2.7452546e-10 ] [ 1.9751864e-10 2.542518e-10 1.785233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 6e-06 -4.6e-06 ] [ 7.4e-06 -7.9e-06 -1.4e-06 ] [ -5.1e-06 3.8e-06 2.6e-06 ] [ 3.1e-06 -5.3e-06 8.8e-06 ] [ -4e-06 3.4e-06 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-15 9.6130597248e-15 -7.370012455680001e-15 ] [ 1.185610699392e-14 -1.265719530432e-14 -2.24304726912e-15 ] [ -8.17110076608e-15 6.08827115904e-15 4.16565921408e-15 ] [ 4.96674752448e-15 -8.491536090240001e-15 1.409915426304e-14 ] [ -6.4087064832e-15 5.44740051072e-15 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.993779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.402268217124201e-18 } }