{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.772287 -2.6293403 -1.8522688 ] [ -3.3561536 1.5768974 2.5532312 ] [ -0.6216113 0.2389876 -6.5801365 ] [ 4.564519 -4.4457713 2.8215839 ] [ 1.1855329 5.2592266 3.0575903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.839516796747769e-09 -4.212667556787259e-09 -2.967661766797271e-09 ] [ -5.377150833733755e-09 2.526468147680306e-09 4.090727336137129e-09 ] [ -9.95931092085095e-10 3.829003453811021e-10 -1.054254086197274e-08 ] [ 7.313165626997396e-09 -7.122910838283623e-09 4.520675758205685e-09 ] [ 1.899433095569224e-09 8.426209902009473e-09 4.898799694644859e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.992038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.241771616094519e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4390907 0.9147368 0.7985813 ] [ 2.3255671 2.2108583 2.798723 ] [ 4.0490648 2.432935 -0.0938517 ] [ 4.5066255 1.3406262 2.0631902 ] [ 3.9355539 3.7290491 1.9062977 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4390907e-10 9.147368e-11 7.985813e-11 ] [ 2.3255671e-10 2.2108583e-10 2.798723e-10 ] [ 4.0490648e-10 2.432935e-10 -9.38517e-12 ] [ 4.5066255e-10 1.3406262e-10 2.0631902e-10 ] [ 3.9355539e-10 3.7290491e-10 1.9062977e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 6.4e-06 6.4e-06 ] [ 4.1e-06 -2.4e-06 -7e-06 ] [ 1.2e-06 8.8e-06 1.85e-05 ] [ 2.7e-06 -1.02e-05 -1.2e-06 ] [ -6.7e-06 -2.6e-06 -1.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.08282960704e-15 1.025393037312e-14 1.025393037312e-14 ] [ 6.568924145279999e-15 -3.84522388992e-15 -1.12152363456e-14 ] [ 1.92261194496e-15 1.409915426304e-14 2.96402674848e-14 ] [ 4.32587687616e-15 -1.634220153216e-14 -1.92261194496e-15 ] [ -1.073458335936e-14 -4.16565921408e-15 -2.659613190528e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }