{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2105271 -8.507425 2.0892724 ] [ -5.6918212 10.2426605 -0.4416906 ] [ 0.0078245 -0.0648971 4.9075798 ] [ 3.7416721 -2.8256868 -10.1018272 ] [ 8.1528516 1.1553485 3.5466657 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.950361322464823e-09 -1.363039743820944e-08 3.347383393762706e-09 ] [ -9.119302856413802e-09 1.641055118789164e-08 -7.076663529471244e-10 ] [ 1.25362309694496e-11 -1.039766163777197e-10 7.86280962027034e-09 ] [ 5.99481956131964e-09 -4.527249328663166e-09 -1.618491136720152e-08 ] [ 1.306230822637187e-08 1.851072355576349e-09 5.682384866333267e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7751236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.245712125575033e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7160162 0.7358452 1.9736861 ] [ 2.2564718 3.2976354 1.6657536 ] [ 2.874976 1.8998878 3.8136368 ] [ 3.5410769 1.3530773 0.4336289 ] [ 4.7000292 2.5171314 2.2735768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7160162e-10 7.358452e-11 1.9736861e-10 ] [ 2.2564718e-10 3.2976354e-10 1.6657536e-10 ] [ 2.874976000000001e-10 1.8998878e-10 3.8136368e-10 ] [ 3.5410769e-10 1.3530773e-10 4.336289e-11 ] [ 4.7000292e-10 2.5171314e-10 2.2735768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 -1.3e-06 2.1e-06 ] [ -4.31e-05 3.39e-05 -1.46e-05 ] [ -1.55e-05 -1.33e-05 4.04e-05 ] [ 4.3e-06 -2.15e-05 -3.35e-05 ] [ 5.39e-05 2.3e-06 5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-16 -2.08282960704e-15 3.36457090368e-15 ] [ -6.905381235648e-14 5.431378744512e-14 -2.339177866368e-14 ] [ -2.48337376224e-14 -2.130894905664e-14 6.472793548032e-14 ] [ 6.889359469440001e-15 -3.44467973472e-14 -5.36729167968e-14 ] [ 8.635731986112e-14 3.68500622784e-15 8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }