{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3671131 0.8694247 0.5684234 ] [ 0.4193369 -0.5153361 -0.1431369 ] [ -3.0768593 -1.7837631 0.5846646 ] [ -0.8931572 -0.1187961 -0.7872931 ] [ 3.1835665 1.5484706 -0.222658 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.881800308553053e-10 1.39297193936246e-09 9.107146896988356e-10 ] [ 6.718517829539945e-10 -8.256594580766873e-10 -2.293305966431946e-10 ] [ -4.929672076565596e-09 -2.857903559411405e-09 9.367359608469562e-10 ] [ -1.430995596328865e-09 -1.903323356303274e-10 -1.261382608929425e-09 ] [ 5.10063585908516e-09 2.48092341375596e-09 -3.56737444973172e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.398166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.986405186965324e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8181404 2.3857567 1.7417969 ] [ 4.8440682 1.7478039 2.8594862 ] [ 3.0919604 2.8319138 4.0771373 ] [ 3.1042101 4.6413187 2.510691 ] [ 5.1301378 4.0033659 3.6283807 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8181404e-10 2.3857567e-10 1.7417969e-10 ] [ 4.8440682e-10 1.7478039e-10 2.8594862e-10 ] [ 3.0919604e-10 2.8319138e-10 4.077137300000001e-10 ] [ 3.1042101e-10 4.6413187e-10 2.510691e-10 ] [ 5.130137800000001e-10 4.0033659e-10 3.6283807e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -5.4e-06 -5.7e-06 ] [ 2.7e-06 -6.2e-06 -1e-07 ] [ -3e-07 1e-07 1.4e-06 ] [ -1.8e-06 6.3e-06 5e-07 ] [ 4.5e-06 5.1e-06 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-15 -8.6517538236e-15 -9.1324068138e-15 ] [ 4.3258769118e-15 -9.9334951308e-15 -1.602176634e-16 ] [ -4.806529901999999e-16 1.602176634e-16 2.2430472876e-15 ] [ -2.8839179412e-15 1.00937127942e-14 8.010883169999999e-16 ] [ 7.209794853e-15 8.1711008334e-15 6.088271209199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }