{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2615356 -2.9594889 0.4772578 ] [ -0.3295585 1.0180686 -2.5393625 ] [ -0.5091413 2.7188757 1.8514691 ] [ 0.4982458 -3.4928312 0.9592045 ] [ -0.9210816 2.7153757 -0.7485689 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.02120286127917e-09 -4.741623964162362e-09 7.646512955542452e-10 ] [ -5.280109282360889e-10 1.631125722729092e-09 -4.068507262755825e-09 ] [ -8.157342942643842e-10 4.356119117290393e-09 2.966380530593009e-09 ] [ 7.982777787486371e-10 -5.596132535146181e-09 1.536815037127653e-09 ] [ -1.475735417527334e-09 4.350511499071393e-09 -1.199339600519083e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.114061432689672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.780668953629596e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1725973 0.1530098 2.3088864 ] [ 0.2841904 1.5010443 0.3474566 ] [ 0.2392622 2.305312 3.3286888 ] [ 2.5235406 0.5342676 2.241459 ] [ 1.8587255 2.7407411 1.6361834 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.725973e-11 1.530098e-11 2.3088864e-10 ] [ 2.841904e-11 1.5010443e-10 3.474566e-11 ] [ 2.392622e-11 2.305312e-10 3.3286888e-10 ] [ 2.5235406e-10 5.342676e-11 2.241459e-10 ] [ 1.8587255e-10 2.7407411e-10 1.6361834e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.34e-05 -1.42e-05 -7e-06 ] [ -3.45e-05 -1.88e-05 -1.26e-05 ] [ -2.27e-05 4e-06 1.53e-05 ] [ 2.68e-05 1.07e-05 -4e-07 ] [ 5.38e-05 1.82e-05 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.749093323559999e-14 -2.27509082028e-14 -1.1215236438e-14 ] [ -5.527509387299999e-14 -3.012092071919999e-14 -2.01874255884e-14 ] [ -3.636940959179999e-14 6.408706535999999e-15 2.45133025002e-14 ] [ 4.293833379119999e-14 1.71432899838e-14 -6.408706536e-16 ] [ 8.619710290919999e-14 2.915961473879999e-14 7.370012516399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }