{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1629416 2.8421016 -1.1317967 ] [ -3.396893 -2.1762095 5.5281286 ] [ -6.681574 -5.4157929 -1.7171088 ] [ 3.4456766 -3.0439606 -6.7528126 ] [ 8.9844525 -4.3218497 0.5920476 ] [ 1.5414909 8.5586331 6.2519877 ] [ 3.2697886 3.557078 -2.7704459 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.147629756767575e-08 4.553548737458273e-09 -1.813338212238591e-09 ] [ -5.442422547959174e-09 -3.486671982862858e-09 8.857038399695834e-09 ] [ -1.070506165294514e-08 -8.677056767474632e-09 -2.751111574729943e-09 ] [ 5.520582491357634e-09 -4.876962507956341e-09 -1.081919847236366e-08 ] [ 1.439467974618811e-08 -6.924366547951494e-09 9.485648231207503e-10 ] [ 2.469740681155951e-09 1.371244185882503e-08 1.001678852646916e-08 ] [ 5.238778849878364e-09 5.699067209962023e-09 -4.438743650171215e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4504553 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.13041543357545e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3271214 2.942408 2.9139569 ] [ 3.0474475 0.9168626 5.2742061 ] [ 1.8608589 0.618541 3.1436311 ] [ 4.0752559 0.8394582 2.102493 ] [ 5.0443932 0.1772029 4.186043 ] [ 3.1393977 3.2643334 4.8465472 ] [ 3.9326323 3.2045963 2.3987157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3271214e-10 2.942408e-10 2.9139569e-10 ] [ 3.0474475e-10 9.168626e-11 5.2742061e-10 ] [ 1.8608589e-10 6.18541e-11 3.1436311e-10 ] [ 4.0752559e-10 8.394582000000001e-11 2.102493e-10 ] [ 5.0443932e-10 1.772029e-11 4.186043e-10 ] [ 3.1393977e-10 3.2643334e-10 4.8465472e-10 ] [ 3.9326323e-10 3.2045963e-10 2.3987157e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.1e-06 5.3e-06 -1.9e-06 ] [ 1.6e-06 -2.7e-06 -1.31e-05 ] [ -2.03e-05 -1.25e-05 -3.9e-06 ] [ 3.1e-06 -1.6e-06 7.6e-06 ] [ 1.26e-05 9e-07 2.4e-06 ] [ 1.7e-06 1.2e-05 2.28e-05 ] [ 1.05e-05 -1.3e-06 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.457980724928e-14 8.491536090240001e-15 -3.04413557952e-15 ] [ 2.56348259328e-15 -4.32587687616e-15 -2.098851373248e-14 ] [ -3.252418540224e-14 -2.002720776e-14 -6.24848882112e-15 ] [ 4.96674752448e-15 -2.56348259328e-15 1.217654231808e-14 ] [ 2.018742542208e-14 1.44195895872e-15 3.84522388992e-15 ] [ 2.72370025536e-15 1.92261194496e-14 3.652962695424e-14 ] [ 1.68228545184e-14 -2.08282960704e-15 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.819793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.89373960072955e-18 } }