{ "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" [ [ 0.4191919 0.8222526 0.2510936 ] [ 0.2848942 2.623705 0.3718827 ] [ 0.6213019 2.72569 2.983351 ] [ 2.411362 0.3472546 0.8650246 ] [ 2.114314 0.6145619 2.800723 ] [ 2.695562 2.69906 2.453497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.191919e-11 8.222526e-11 2.510936e-11 ] [ 2.848942e-11 2.623705000000001e-10 3.718827e-11 ] [ 6.213019e-11 2.72569e-10 2.983351e-10 ] [ 2.411362e-10 3.472546e-11 8.650246000000001e-11 ] [ 2.114314e-10 6.145619e-11 2.800723e-10 ] [ 2.695562e-10 2.69906e-10 2.453497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.462637 -17.878435 -3.5316477 ] [ -2.1041045 18.8769689 5.5667725 ] [ -5.3169366 1.3254147 -2.7629283 ] [ 3.1204305 -4.4042624 -8.6355813 ] [ -0.8398766 -2.7579465 9.4136405 ] [ 5.6031242 4.8382603 -0.0502558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.41226191423858e-10 -2.864441080948779e-08 -5.658323424459841e-09 ] [ -3.371147065394253e-09 3.024423849232468e-08 8.918952826293762e-09 ] [ -8.518671584979404e-09 2.12354846270012e-09 -4.426699163677342e-09 ] [ 4.999480835120937e-09 -7.056406307284761e-09 -1.383572657986734e-08 ] [ -1.345630663963364e-09 -4.41871744012208e-09 1.508231484997608e-08 ] [ 8.977194670639943e-09 7.75174760186983e-09 -8.05186684829772e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8804643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.102371913253116e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4773714 0.7221615 -0.4734106 ] [ -0.2947949 2.5877606 0.6561536 ] [ 0.7511069 2.8155553 2.7145223 ] [ 2.0645955 -0.3090079 0.8570203 ] [ 2.3616716 0.8380914 2.8516582 ] [ 3.1866755 3.1779633 3.1196281 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.773714e-11 7.221615e-11 -4.734106000000001e-11 ] [ -2.947949e-11 2.5877606e-10 6.561536e-11 ] [ 7.511069000000001e-11 2.815555300000001e-10 2.7145223e-10 ] [ 2.0645955e-10 -3.090079e-11 8.570203e-11 ] [ 2.3616716e-10 8.380914000000001e-11 2.8516582e-10 ] [ 3.1866755e-10 3.1779633e-10 3.1196281e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.04e-05 -3.17e-05 4.73e-05 ] [ 1.27e-05 4.08e-05 -7.4e-06 ] [ -1.5e-05 1.15e-05 3.4e-06 ] [ -1.8e-05 -4.5e-06 -3.55e-05 ] [ 4.49e-05 1.83e-05 -1.3e-06 ] [ -4.49e-05 -3.44e-05 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.26844033336e-14 -5.078899929779999e-14 7.578295478819998e-14 ] [ 2.03476432518e-14 6.53688066672e-14 -1.18561070916e-14 ] [ -2.403264951e-14 1.8425031291e-14 5.4474005556e-15 ] [ -2.8839179412e-14 -7.209794853e-15 -5.6877270507e-14 ] [ 7.193773086659999e-14 2.93198324022e-14 -2.0828296242e-15 ] [ -7.193773086659999e-14 -5.51148762096e-14 -1.02539304576e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.748985 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.363047914221649e-18 } }