{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -38.4669292 4.7102489 -22.633224 ] [ 36.8648993 56.7630321 -5.2293628 ] [ -53.3192213 -41.4019708 -41.1213866 ] [ 8.7849754 -28.1158052 -20.4782062 ] [ 60.5922894 -21.3385659 51.2593822 ] [ -32.823981 34.707856 13.5963864 ] [ 18.3679673 -5.3247951 24.606411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.16308151459723e-08 7.546650727904203e-09 -3.6262422644888e-08 ] [ 5.906408027322295e-08 9.094440370561193e-08 -8.378362888868813e-09 ] [ -8.542681050993509e-08 -6.633327021731029e-08 -6.58837247682007e-08 ] [ 1.40750823161448e-08 -4.504648613753569e-08 -3.280970347987393e-08 ] [ 9.707955027724586e-08 -3.418815168804918e-08 8.21265844341155e-08 ] [ -5.258981539305996e-08 5.56081158994367e-08 2.178381259691538e-08 ] [ 2.942872802213606e-08 -8.531262290057692e-09 3.942381675080057e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.058353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.37392011271238e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3634592 1.9924434 1.8114207 ] [ 2.4393069 5.1179392 4.3076943 ] [ 0.4600946 3.1408359 3.6826329 ] [ 4.9572772 2.4023256 0.6212987 ] [ 3.482849 2.47288 4.416222 ] [ 3.5597056 4.9910948 1.7849271 ] [ 5.6964226 3.5344711 3.1602874 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3634592e-10 1.9924434e-10 1.8114207e-10 ] [ 2.4393069e-10 5.1179392e-10 4.3076943e-10 ] [ 4.600946e-11 3.1408359e-10 3.682632900000001e-10 ] [ 4.9572772e-10 2.4023256e-10 6.212987e-11 ] [ 3.482849e-10 2.47288e-10 4.416222000000001e-10 ] [ 3.5597056e-10 4.9910948e-10 1.7849271e-10 ] [ 5.6964226e-10 3.534471100000001e-10 3.1602874e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.64e-05 3.03e-05 1.37e-05 ] [ 2.09e-05 -4.84e-05 2.3e-06 ] [ -9.84e-05 -7.2e-06 2.52e-05 ] [ 1.03e-05 -2.95e-05 -7.5e-06 ] [ 3.81e-05 1.48e-05 -1.51e-05 ] [ 2.78e-05 3e-05 -3.11e-05 ] [ -2.51e-05 1e-05 1.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.22974631376e-14 4.854595201019999e-14 2.19498198858e-14 ] [ 3.34854916506e-14 -7.754534908559998e-14 3.685006258199999e-15 ] [ -1.576541807856e-13 -1.15356717648e-14 4.037485117679999e-14 ] [ 1.65024193302e-14 -4.726421070299999e-14 -1.2016324755e-14 ] [ 6.10429297554e-14 2.37122141832e-14 -2.41928671734e-14 ] [ 4.454051042519999e-14 4.806529901999999e-14 -4.982769331739999e-14 ] [ -4.02146335134e-14 1.602176634e-14 2.0027207925e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.470818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.959351301046661e-18 } }