{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.617948 3.024291 1.012928 ] [ 1.30973 1.622672 3.703727 ] [ 2.879916 3.04735 3.836046 ] [ 0.9226834 3.798669 3.025472 ] [ 3.183378 1.61886 2.358361 ] [ 3.567629 4.016165 2.010815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.617948e-10 3.024291e-10 1.012928e-10 ] [ 1.30973e-10 1.622672e-10 3.703727e-10 ] [ 2.879916000000001e-10 3.04735e-10 3.836046e-10 ] [ 9.226834e-11 3.798669e-10 3.025472e-10 ] [ 3.183378e-10 1.61886e-10 2.358361e-10 ] [ 3.567629e-10 4.016165e-10 2.010815e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.470937 -0.3490085 -3.239537 ] [ -6.8789023 -6.9971838 2.3232038 ] [ 5.4308523 7.6758496 11.9652643 ] [ -4.8642413 3.7963001 0.23661 ] [ 3.5508166 -7.9536173 -7.3380303 ] [ 3.2324117 3.8276599 -3.9475108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.545242574860579e-10 -5.591732637673889e-10 -5.190310486378458e-09 ] [ -1.102121653262886e-08 -1.121072438816333e-08 3.722182844380009e-09 ] [ 8.701184657765158e-09 1.229806687521824e-08 1.917046688109436e-08 ] [ -7.793373752997783e-09 6.082343315871863e-09 3.790910133707399e-10 ] [ 5.689035388139324e-09 -1.274309979383817e-08 -1.175682068624401e-08 ] [ 5.178894497208217e-09 6.132587254678776e-09 -6.324609566222646e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.986141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.279520850602939e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0402525 3.2198789 0.9664939 ] [ 1.2186576 1.4348264 4.1801208 ] [ 3.0083653 3.1864266 3.7403556 ] [ 0.6329073 3.544624 2.9687134 ] [ 2.7382454 1.2019079 2.2056697 ] [ 3.8428563 4.5403432 1.8859956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0402525e-10 3.2198789e-10 9.664939000000001e-11 ] [ 1.2186576e-10 1.4348264e-10 4.1801208e-10 ] [ 3.0083653e-10 3.1864266e-10 3.7403556e-10 ] [ 6.329073e-11 3.544624e-10 2.9687134e-10 ] [ 2.7382454e-10 1.2019079e-10 2.2056697e-10 ] [ 3.8428563e-10 4.5403432e-10 1.8859956e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 3e-07 3.7e-06 ] [ -1.95e-05 5e-06 2.4e-06 ] [ 4.6e-06 -1.7e-06 -5.4e-06 ] [ 1.03e-05 -1.57e-05 3.2e-06 ] [ 6.6e-06 8.5e-06 -6e-07 ] [ 3.1e-06 3.6e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.1711008334e-15 4.806529901999999e-16 5.9280535458e-15 ] [ -3.1242444363e-14 8.010883169999999e-15 3.845223921599999e-15 ] [ 7.370012516399999e-15 -2.7237002778e-15 -8.6517538236e-15 ] [ 1.65024193302e-14 -2.515417315379999e-14 5.1269652288e-15 ] [ 1.05743657844e-14 1.3618501389e-14 -9.613059803999998e-16 ] [ 4.9667475654e-15 5.767835882399999e-15 -5.2871828922e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.766358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.205613712287897e-18 } }