{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4044782 -0.950513 -2.5118275 ] [ -2.0937221 -2.2450815 2.2841397 ] [ -0.2625194 1.931767 2.066327 ] [ 0.8940419 -2.4630996 -2.1066297 ] [ 2.8652786 -3.3353984 0.1883687 ] [ 1.1381667 4.1950416 -1.833817 ] [ -1.1367675 2.8672839 1.9134388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.250222155002378e-09 -1.522889718913242e-09 -4.024391329138635e-09 ] [ -3.354512626709411e-09 -3.59701712072567e-09 3.659595256131769e-09 ] [ -4.206024486516996e-10 3.095031949732278e-09 3.310620837603317e-09 ] [ 1.432413041996964e-09 -3.946320626334746e-09 -3.37519288183043e-09 ] [ 4.590682422820231e-09 -5.343897381560985e-09 3.017999297169558e-10 ] [ 1.823544092336888e-09 6.721197630177974e-09 -2.938098748431978e-09 ] [ -1.821302326790595e-09 4.593895267624392e-09 3.065666935948999e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.12000406491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582709385279406e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6394573 2.2761536 1.1648652 ] [ 2.6684022 1.6021512 3.4129828 ] [ 1.9009251 4.0318911 2.7441145 ] [ 4.0427115 1.7598162 1.1963358 ] [ 5.2265863 1.4747652 3.3318243 ] [ 4.1912006 4.0952943 1.8140809 ] [ 4.3243189 3.4905075 4.2079976 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6394573e-10 2.2761536e-10 1.1648652e-10 ] [ 2.6684022e-10 1.6021512e-10 3.4129828e-10 ] [ 1.9009251e-10 4.0318911e-10 2.7441145e-10 ] [ 4.0427115e-10 1.7598162e-10 1.1963358e-10 ] [ 5.2265863e-10 1.4747652e-10 3.3318243e-10 ] [ 4.191200600000001e-10 4.0952943e-10 1.8140809e-10 ] [ 4.3243189e-10 3.4905075e-10 4.2079976e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.21e-05 4.4e-05 8.8e-06 ] [ 3.02e-05 2.75e-05 0.0 ] [ 6.71e-05 -0.0001001 -2.07e-05 ] [ -3.18e-05 2.85e-05 1.02e-05 ] [ -3.5e-05 5.18e-05 7.6e-06 ] [ 3.8e-06 -3.3e-05 -1.14e-05 ] [ -2.22e-05 -1.89e-05 5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.93863372714e-14 7.049577189599999e-14 1.40991543792e-14 ] [ 4.838573434679999e-14 4.4059857435e-14 0.0 ] [ 1.075060521414e-13 -1.603778810634e-13 -3.316505632379999e-14 ] [ -5.09492169612e-14 4.5662034069e-14 1.63422016668e-14 ] [ -5.607618218999999e-14 8.299274964119999e-14 1.21765424184e-14 ] [ 6.088271209199999e-15 -5.287182892199999e-14 -1.82648136276e-14 ] [ -3.55683212748e-14 -3.02811383826e-14 8.811971486999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.180097064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.912772672126102e-18 } }