{ "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" [ [ 11.9023604 -23.9682387 -56.8426088 ] [ -22.1075092 22.8369998 49.6294426 ] [ -0.5294417 1.0677006 1.0488662 ] [ -0.1959669 0.1596984 -1.1255581 ] [ 10.9305574 -0.0961601 7.2898581 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906968356521573e-08 -3.840135168689379e-08 -9.107189888464033e-08 ] [ -3.542013438436091e-08 3.658890716877428e-08 7.951513263705557e-08 ] [ -8.482591138166074e-10 1.710644939334133e-09 1.680468903987337e-09 ] [ -3.139735856306515e-10 2.558650428591667e-10 -1.803342873172068e-09 ] [ 1.751268351859243e-08 -1.540654640737901e-10 1.167964021676951e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3267879 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.125748554140329e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.249263 1.835052 -0.2352258 ] [ 0.1781346 3.3046726 1.4923354 ] [ 1.8279116 0.2746068 0.236146 ] [ 2.7324421 0.7798191 2.2550312 ] [ 1.7128239 2.652503 3.0313986 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.49263e-11 1.835052e-10 -2.352258e-11 ] [ 1.781346e-11 3.3046726e-10 1.4923354e-10 ] [ 1.8279116e-10 2.746068e-11 2.36146e-11 ] [ 2.7324421e-10 7.798191e-11 2.2550312e-10 ] [ 1.7128239e-10 2.652503e-10 3.0313986e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 4e-07 -0.0 ] [ 1.6e-06 -1.6e-06 2e-07 ] [ 1.2e-06 2e-07 2.1e-06 ] [ -3.4e-06 2.8e-06 -1.9e-06 ] [ 1e-06 -1.7e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 6.408706483200001e-16 0.0 ] [ 2.56348259328e-15 -2.56348259328e-15 3.2043532416e-16 ] [ 1.92261194496e-15 3.2043532416e-16 3.36457090368e-15 ] [ -5.44740051072e-15 4.48609453824e-15 -3.04413557952e-15 ] [ 1.6021766208e-15 -2.72370025536e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.066442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41391011310392e-18 } }