{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.320516e-11 8.75692e-11 3.257986e-11 ] [ 7.120975e-11 3.2824762e-10 7.895263e-11 ] [ 1.327837e-11 1.7327994e-10 2.6198871e-10 ] [ 2.0974054e-10 3.461386e-11 2.0677993e-10 ] [ 2.6767271e-10 1.89596e-10 2.375137e-11 ] [ 2.3773235e-10 2.7527159e-10 2.5314768e-10 ] ] "source-value" [ [ 0.4320516 0.875692 0.3257986 ] [ 0.7120975 3.2824762 0.7895263 ] [ 0.1327837 1.7327994 2.6198871 ] [ 2.0974054 0.3461386 2.0677993 ] [ 2.6767271 1.89596 0.2375137 ] [ 2.3773235 2.7527159 2.5314768 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.2420043921888e-12 2.9704354549632e-13 3.16429882608e-12 ] [ 2.04277519152e-12 -2.1565297315968e-12 2.53928972630592e-12 ] [ 1.52399040170496e-12 -3.685006227840001e-13 -2.63013314070528e-12 ] [ -3.10630003240704e-12 1.12809255870528e-12 -3.4639058541696e-12 ] [ -2.615553333456e-12 -1.22101880271168e-12 1.25786886499008e-12 ] [ -1.08675640188864e-12 2.32091305289088e-12 -8.672582048390401e-13 ] ] "source-value" [ [ 0.0020235 0.0001854 0.001975 ] [ 0.001275 -0.001346 0.0015849 ] [ 0.0009512 -0.00023 -0.0016416 ] [ -0.0019388 0.0007041 -0.002162 ] [ -0.0016325 -0.0007621 0.0007851 ] [ -0.0006783 0.0014486 -0.0005413 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.295436662057156e-18 "source-value" -20.568498 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.413330004154862e-09 -7.648169543170329e-09 -1.521922183948702e-08 ] [ -6.978228201154223e-09 1.344862136817294e-08 -2.710776297648317e-09 ] [ -1.411753122888058e-09 -2.217019108826794e-09 5.588498277660358e-09 ] [ 4.258099517917311e-09 -7.246961445978669e-09 9.875734018297567e-09 ] [ 8.601395738951635e-09 -2.366805639799413e-09 -7.604318129276695e-09 ] [ 3.943815911110535e-09 6.030334369602265e-09 1.00700839704541e-08 ] ] "source-value" [ [ -5.2511876 -4.773612 -9.4990912 ] [ -4.3554675 8.3939693 -1.6919335 ] [ -0.881147 -1.3837545 3.4880663 ] [ 2.6576967 -4.5231976 6.1639484 ] [ 5.368569 -1.4772439 -4.7462421 ] [ 2.4615363 3.7638387 6.2852521 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.463609631881136e-18 "source-value" -15.376642 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] "source-value" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] } "instance-id" 1 }