{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7714874 -2.1124804 -2.601268 ] [ -4.4550503 -16.0810369 3.3418743 ] [ -11.0090618 -2.8160596 -1.9723888 ] [ 1.4460998 14.8247479 8.4147821 ] [ 2.5853141 -0.2369216 1.6020369 ] [ 9.6263484 14.1983264 -2.6948029 ] [ 2.5778372 -7.7765758 -6.0902336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.236059085705411e-09 -3.384566736662973e-09 -4.167690808371912e-09 ] [ -7.13777749395469e-09 -2.576466157167179e-08 5.354272917225106e-09 ] [ -1.763846157822198e-08 -4.511824891071386e-09 -3.160115248523299e-09 ] [ 2.316907309992073e-09 2.375186469032057e-08 1.348196726082145e-08 ] [ 4.142129842570739e-09 -3.795902516098944e-10 2.566746087985795e-09 ] [ 1.542311047722328e-08 2.274822679998533e-08 -4.317550239615438e-09 ] [ 4.130150528095984e-09 -1.245944803928986e-08 -9.757629969521701e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.7748115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.405879795305449e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8252266 0.9640503 1.6856825 ] [ 2.9075727 1.9753818 3.9395284 ] [ 2.0708401 4.8910943 1.4724623 ] [ 1.6342745 4.086092 3.7675268 ] [ 5.1945959 2.6263245 4.2760099 ] [ 4.2654149 5.8643561 1.5359173 ] [ 2.2816663 2.8572657 0.0837784 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8252266e-10 9.640503000000001e-11 1.6856825e-10 ] [ 2.9075727e-10 1.9753818e-10 3.9395284e-10 ] [ 2.0708401e-10 4.8910943e-10 1.4724623e-10 ] [ 1.6342745e-10 4.086092e-10 3.7675268e-10 ] [ 5.1945959e-10 2.6263245e-10 4.2760099e-10 ] [ 4.2654149e-10 5.864356100000001e-10 1.5359173e-10 ] [ 2.2816663e-10 2.8572657e-10 8.377840000000001e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.3e-06 8.4e-06 3.2e-06 ] [ -4.3e-05 6e-07 1.6e-05 ] [ 3.22e-05 1.42e-05 3.08e-05 ] [ -4.8e-06 -1.66e-05 -1.3e-06 ] [ 3.27e-05 3.92e-05 -2.46e-05 ] [ 1e-06 -9.2e-06 2.62e-05 ] [ -9.7e-06 -3.65e-05 -5.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.32980660622e-14 1.34582837256e-14 5.1269652288e-15 ] [ -6.889359526199999e-14 9.613059803999998e-16 2.5634826144e-14 ] [ 5.159008761479998e-14 2.27509082028e-14 4.93470403272e-14 ] [ -7.690447843199998e-15 -2.65961321244e-14 -2.0828296242e-15 ] [ 5.23911759318e-14 6.280532405279998e-14 -3.94135451964e-14 ] [ 1.602176634e-15 -1.47400250328e-14 4.197702781079999e-14 ] [ -1.55411133498e-14 -5.847944714099999e-14 -8.04292670268e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.205388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.237260053450399e-18 } }