{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1919567 -0.2300279 -0.9448699 ] [ 0.4425095 -1.097571 -0.4901543 ] [ 1.4153382 -0.0743509 1.1427857 ] [ -5.0998222 1.9772112 2.0148763 ] [ 2.6736221 -3.414022 -6.5801722 ] [ 0.9336527 6.0761762 -0.5661335 ] [ 1.8266564 -3.2374156 5.4236678 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.511901778545919e-09 -3.685453235117203e-10 -1.513848463477634e-09 ] [ 7.089783753818977e-10 -1.758502595868077e-09 -7.853137600445895e-10 ] [ 2.267621774565155e-09 -1.191232737154387e-10 1.830944531124562e-09 ] [ -8.170815899076822e-09 3.167841559023913e-09 3.228187701664007e-09 ] [ 4.283614821474199e-09 -5.469866231296858e-09 -1.05425980596781e-08 ] [ 1.495876527886796e-09 9.735107451501385e-09 -9.070458579516767e-10 ] [ 2.926626178314693e-09 -5.186911586133205e-09 8.689673748145769e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.786186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.728137503680027e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7771856 3.2099378 2.7783453 ] [ 2.6701922 2.1690024 1.664147 ] [ 2.3497681 1.8475757 4.0714921 ] [ 1.7890198 5.1182206 3.5016865 ] [ 4.2439389 3.7683086 2.0567191 ] [ 3.0744394 5.6866684 1.7160742 ] [ 3.5306168 3.7986766 4.2548778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.771856e-11 3.2099378e-10 2.7783453e-10 ] [ 2.6701922e-10 2.1690024e-10 1.664147e-10 ] [ 2.3497681e-10 1.8475757e-10 4.0714921e-10 ] [ 1.7890198e-10 5.1182206e-10 3.5016865e-10 ] [ 4.2439389e-10 3.7683086e-10 2.0567191e-10 ] [ 3.074439400000001e-10 5.6866684e-10 1.7160742e-10 ] [ 3.530616800000001e-10 3.7986766e-10 4.2548778e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 1.02e-05 6.1e-06 ] [ -1.05e-05 4e-07 -2.36e-05 ] [ 1.79e-05 -1.6e-06 -1e-06 ] [ -3.15e-05 -2e-06 2.23e-05 ] [ 1.16e-05 -4.4e-06 -8.4e-06 ] [ 2.3e-05 -2.19e-05 -8.3e-06 ] [ -1.05e-05 1.93e-05 1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 1.634220153216e-14 9.77327738688e-15 ] [ -1.68228545184e-14 6.408706483200001e-16 -3.781136825088e-14 ] [ 2.867896151232001e-14 -2.56348259328e-15 -1.6021766208e-15 ] [ -5.04685635552e-14 -3.2043532416e-15 3.572853864384e-14 ] [ 1.858524880128e-14 -7.04957713152e-15 -1.345828361472e-14 ] [ 3.68500622784e-14 -3.508766799552e-14 -1.329806595264e-14 ] [ -1.68228545184e-14 3.092200878144e-14 2.08282960704e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.4213 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.310546970154304e-18 } }