{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4144094 -1.8638731 -2.268414 ] [ 0.8424912 -1.2857007 -4.0939721 ] [ -0.1865944 2.8194912 1.6051179 ] [ 0.6464692 -0.3114479 2.4695335 ] [ 2.1120434 0.6415306 2.2877347 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.470486914519755e-09 -2.986253904958021e-09 -3.634399877095411e-09 ] [ 1.349819703869737e-09 -2.059919602886195e-09 -6.55926638482748e-09 ] [ -2.989571852522035e-10 4.517322883191337e-09 2.571682373007592e-09 ] [ 1.035757838307279e-09 -4.989945439772563e-10 3.956628837982397e-09 ] [ 3.383866557594943e-09 1.027845328847797e-09 3.665355050932902e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.851602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.539706612662652e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9953888 2.5212212 0.2727175 ] [ 1.7343359 2.8316591 2.6904506 ] [ 2.7241451 0.8067125 1.8144385 ] [ 2.408308 4.6790212 1.2831295 ] [ 3.9689392 2.8757158 1.683184 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9953888e-10 2.5212212e-10 2.727175e-11 ] [ 1.7343359e-10 2.8316591e-10 2.6904506e-10 ] [ 2.7241451e-10 8.067125e-11 1.8144385e-10 ] [ 2.408308e-10 4.6790212e-10 1.2831295e-10 ] [ 3.9689392e-10 2.8757158e-10 1.683184e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.71e-05 1.17e-05 -3.2e-06 ] [ 1.89e-05 1.87e-05 7.3e-06 ] [ -1.63e-05 -7.9e-06 -2.1e-06 ] [ -1.27e-05 -3.55e-05 5.7e-06 ] [ -1.69e-05 1.3e-05 -7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.341898642368e-14 1.874546646336e-14 -5.126965186560001e-15 ] [ 3.028113813312e-14 2.996070280896e-14 1.169588933184e-14 ] [ -2.611547891904e-14 -1.265719530432e-14 -3.36457090368e-15 ] [ -2.034764308416e-14 -5.68772700384e-14 9.13240673856e-15 ] [ -2.707678489152e-14 2.08282960704e-14 -1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }