{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4024285 5.4960242 2.9220549 ] [ 3.7870305 -3.8859321 -3.680751 ] [ -0.4384568 -5.6675224 -3.9994721 ] [ 2.6286204 -1.0294985 2.1025087 ] [ -3.7583997 -8.1468059 5.9775001 ] [ -2.2628005 1.6337671 -4.8866079 ] [ 6.4464346 11.5999676 1.5647672 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.025782134355567e-08 8.80560155313854e-09 4.681648084045206e-09 ] [ 6.067491779345337e-09 -6.22594961193055e-09 -5.897213247772133e-09 ] [ -7.024852399784111e-10 -9.080371961951601e-09 -6.407860746954911e-09 ] [ 4.211514184535733e-09 -1.649438441438049e-09 3.368590311921716e-09 ] [ -6.021620180572609e-09 -1.305262205471334e-08 9.577010989952663e-09 ] [ -3.625406088503516e-09 2.617583473017941e-09 -7.829208996899807e-09 ] [ 1.032832688872913e-08 1.858519704387706e-08 2.507033445489604e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.559882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.012314946619719e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9086129 4.0022945 3.119279 ] [ 5.8730552 2.3028098 2.0792156 ] [ 3.5120354 1.8323562 1.6720208 ] [ 5.6370496 2.1220638 4.5998021 ] [ 3.2717632 1.7290989 4.2028193 ] [ 2.0567294 3.6629762 0.7966799 ] [ 5.3008603 4.3604384 3.4515929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9086129e-10 4.0022945e-10 3.119279e-10 ] [ 5.8730552e-10 2.3028098e-10 2.0792156e-10 ] [ 3.5120354e-10 1.8323562e-10 1.6720208e-10 ] [ 5.6370496e-10 2.1220638e-10 4.5998021e-10 ] [ 3.2717632e-10 1.7290989e-10 4.2028193e-10 ] [ 2.0567294e-10 3.6629762e-10 7.966799e-11 ] [ 5.300860300000001e-10 4.3604384e-10 3.4515929e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 -1.45e-05 1.87e-05 ] [ -7.1e-06 -1.01e-05 8e-07 ] [ -9e-07 4.6e-06 -1.03e-05 ] [ 9.7e-06 6.6e-06 1.26e-05 ] [ 9.3e-06 8e-07 9.9e-06 ] [ 2.2e-06 1.54e-05 -2.08e-05 ] [ -7e-06 -2.7e-06 -1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.773277467399999e-15 -2.3231561193e-14 2.99607030558e-14 ] [ -1.13754541014e-14 -1.61819840034e-14 1.2817413072e-15 ] [ -1.4419589706e-15 7.370012516399999e-15 -1.65024193302e-14 ] [ 1.55411133498e-14 1.05743657844e-14 2.01874255884e-14 ] [ 1.49002426962e-14 1.2817413072e-15 1.58615486766e-14 ] [ 3.5247885948e-15 2.46735201636e-14 -3.332527398719999e-14 ] [ -1.1215236438e-14 -4.3258769118e-15 -1.74637253106e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.130246 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.744567987587196e-18 } }