{ "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" [ [ 2.026773 2.5022 1.482523 ] [ 1.327692 1.758529 3.84576 ] [ 1.586091 4.007002 3.406328 ] [ 4.160839 1.404559 1.89873 ] [ 3.792152 2.753975 4.110825 ] [ 3.943377 3.908391 2.363825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026773e-10 2.5022e-10 1.482523e-10 ] [ 1.327692e-10 1.758529e-10 3.84576e-10 ] [ 1.586091e-10 4.007002e-10 3.406328e-10 ] [ 4.160839e-10 1.404559e-10 1.89873e-10 ] [ 3.792152e-10 2.753975e-10 4.110825e-10 ] [ 3.943377e-10 3.908391e-10 2.363825e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6624046 0.0243084 -4.3952765 ] [ -0.2813977 -4.2771979 1.1787357 ] [ 0.0662943 4.949925 0.0144634 ] [ 1.2339224 -1.635916 -0.1742375 ] [ 0.7090556 -8.7961576 17.2293509 ] [ 0.93453 9.735038 -13.853036 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.265642405230376e-09 3.894635016905472e-11 -7.042009250251651e-09 ] [ -4.508488160868921e-10 -6.852826477914857e-09 1.888542780642322e-09 ] [ 1.062151775523014e-10 7.93065410971344e-09 2.317292133727872e-11 ] [ 1.976961621161426e-09 -2.621026368792653e-09 -2.7915924896664e-10 ] [ 1.136032305167316e-09 -1.409299805959224e-08 2.760446320353944e-08 ] [ 1.497282117436224e-09 1.559725028619959e-08 -2.219501040630075e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.916693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.909264692185102e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8296139 2.6561171 1.2838658 ] [ 1.6690711 1.4802872 3.6123002 ] [ 1.7252302 4.0890573 3.46693 ] [ 3.8870788 1.3558289 2.2357342 ] [ 3.7826963 2.7887641 4.4187965 ] [ 3.9432339 3.9646013 2.0903642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8296139e-10 2.6561171e-10 1.2838658e-10 ] [ 1.6690711e-10 1.4802872e-10 3.6123002e-10 ] [ 1.7252302e-10 4.0890573e-10 3.46693e-10 ] [ 3.8870788e-10 1.3558289e-10 2.2357342e-10 ] [ 3.7826963e-10 2.7887641e-10 4.4187965e-10 ] [ 3.9432339e-10 3.9646013e-10 2.0903642e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.92e-05 1.24e-05 -3e-05 ] [ -1.33e-05 -3.24e-05 1.29e-05 ] [ 3.8e-06 -1.38e-05 -5.9e-06 ] [ -7.9e-06 3.1e-06 -3e-07 ] [ 1.42e-05 1.58e-05 4.13e-05 ] [ 3.23e-05 1.49e-05 -1.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.678355732736e-14 1.986699009792e-14 -4.8065298624e-14 ] [ -2.130894905664e-14 -5.191052251392001e-14 2.066807840832e-14 ] [ 6.08827115904e-15 -2.211003736704e-14 -9.45284206272e-15 ] [ -1.265719530432e-14 4.96674752448e-15 -4.8065298624e-16 ] [ 2.275090801536e-14 2.531439060864e-14 6.616989443904001e-14 ] [ 5.175030485184e-14 2.387243164992e-14 -2.867896151232001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.315328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.614003708228362e-18 } }