{ "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" [ [ 3.027282 5.632261 2.076972 ] [ 2.884751 3.592598 1.127951 ] [ 2.371812 3.264152 3.427474 ] [ 4.423647 2.751313 2.650154 ] [ 4.69656 4.49664 0.8853521 ] [ 4.67919 4.727196 3.249691 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.027282e-10 5.632261e-10 2.076972e-10 ] [ 2.884751e-10 3.592598e-10 1.127951e-10 ] [ 2.371812e-10 3.264152e-10 3.427474e-10 ] [ 4.423647e-10 2.751313e-10 2.650154e-10 ] [ 4.69656e-10 4.496640000000001e-10 8.853521e-11 ] [ 4.679190000000001e-10 4.727196000000001e-10 3.249691e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0555271 2.5876137 0.2392661 ] [ -5.3654135 -3.2298028 -1.8875471 ] [ -1.097541 0.4975744 0.7846791 ] [ 1.5689054 -4.7727142 -0.5020765 ] [ 4.8141675 1.7454127 -1.9049913 ] [ 2.1354086 3.1719162 3.2706697 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.293317463040824e-09 4.145814173801784e-09 3.833465515699949e-10 ] [ -8.596340070624701e-09 -5.174714535954378e-09 -3.02418383427884e-09 ] [ -1.758454530569453e-09 7.972020707885876e-10 1.257194508850385e-09 ] [ 2.513663552126872e-09 -7.646731109000176e-09 -8.044152301530912e-10 ] [ 7.713146617115184e-09 2.796459421587404e-09 -3.052132523687399e-09 ] [ 3.421301734775259e-09 5.081969978776777e-09 5.24019052769895e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.369539 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.943124592067381e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8604474 5.6055349 2.0482767 ] [ 2.6621382 3.3792356 1.0039178 ] [ 2.5257725 3.6077845 3.45659 ] [ 4.5006175 2.5491776 2.4242658 ] [ 4.8353096 4.546942 1.0159412 ] [ 4.6989567 4.7754854 3.4686025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8604474e-10 5.6055349e-10 2.0482767e-10 ] [ 2.6621382e-10 3.3792356e-10 1.0039178e-10 ] [ 2.5257725e-10 3.6077845e-10 3.45659e-10 ] [ 4.5006175e-10 2.5491776e-10 2.4242658e-10 ] [ 4.8353096e-10 4.546942e-10 1.0159412e-10 ] [ 4.6989567e-10 4.7754854e-10 3.4686025e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.82e-05 -3.68e-05 -1.05e-05 ] [ -7.1e-06 1.79e-05 4.43e-05 ] [ -1.38e-05 -1.9e-06 -9.7e-06 ] [ 1.83e-05 6.79e-05 -2.93e-05 ] [ -6.9e-06 -2.48e-05 3.52e-05 ] [ -2.88e-05 -2.23e-05 -2.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.120314691456e-14 -5.896009964544001e-14 -1.68228545184e-14 ] [ -1.137545400768e-14 2.867896151232001e-14 7.097642430144e-14 ] [ -2.211003736704e-14 -3.04413557952e-15 -1.554111322176e-14 ] [ 2.931983216064e-14 1.0878779255232e-13 -4.694377498944e-14 ] [ -1.105501868352e-14 -3.973398019584e-14 5.639661705216e-14 ] [ -4.614268667904e-14 -3.572853864384e-14 -4.790508096192e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }