{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.008241 -6.7971563 -0.598991 ] [ -0.9234373 5.7797277 -3.7210605 ] [ -0.5980794 1.6711173 5.0073897 ] [ 3.238444 -0.2187058 0.5984295 ] [ 0.9596802 -1.2354235 -0.1075184 ] [ 0.3316335 0.8004406 -1.1782492 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.819733439640793e-09 -1.089024500150589e-08 -9.59689384176294e-10 ] [ -1.479509665024048e-09 9.26014467182256e-09 -5.961796186800356e-09 ] [ -9.582288399567396e-10 2.677425090733168e-09 8.022722774672268e-09 ] [ 5.188559307317496e-09 -3.504053224802772e-10 9.587897619963027e-10 ] [ 1.537577192552447e-09 -1.979366664794499e-09 -1.722634682050656e-10 ] [ 5.313354447516389e-10 1.28244722622494e-09 -1.887763337269193e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.076921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.774718400286391e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.176123 0.1556004 0.004457 ] [ 0.1195181 2.3972146 0.8260896 ] [ 0.3917828 2.2320859 3.1928865 ] [ 2.429663 -0.0869081 0.77111 ] [ 2.5732676 1.2956873 2.8940787 ] [ 2.5778873 2.4455029 0.6283912 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.76123e-11 1.556004e-11 4.457e-13 ] [ 1.195181e-11 2.3972146e-10 8.260896000000001e-11 ] [ 3.917828e-11 2.2320859e-10 3.1928865e-10 ] [ 2.429663e-10 -8.69081e-12 7.7111e-11 ] [ 2.5732676e-10 1.2956873e-10 2.8940787e-10 ] [ 2.5778873e-10 2.4455029e-10 6.283912000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 1.36e-05 2.36e-05 ] [ -1.35e-05 1.49e-05 6.9e-06 ] [ -7.1e-06 -3.3e-06 -1.51e-05 ] [ 8.1e-06 -2.06e-05 -2.16e-05 ] [ -2.6e-06 -4e-07 1.86e-05 ] [ -4e-06 -4.2e-06 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.06015737094e-14 2.17896022224e-14 3.78113685624e-14 ] [ -2.162938455899999e-14 2.38724318466e-14 1.10550187746e-14 ] [ -1.13754541014e-14 -5.2871828922e-15 -2.41928671734e-14 ] [ 1.29776307354e-14 -3.300483866039999e-14 -3.46070152944e-14 ] [ -4.165659248399999e-15 -6.408706536e-16 2.98004853924e-14 ] [ -6.408706535999999e-15 -6.729141862799999e-15 -1.98669902616e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.521764 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.326643096526237e-18 } }