{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1846905 -5.5988717 0.6499912 ] [ -0.8073674 3.7814112 -3.5916702 ] [ -6.3265779 -0.9731124 1.2014692 ] [ 0.4803441 -1.7593199 -1.2474405 ] [ -0.4252854 -3.1395501 -1.788413 ] [ 4.5883708 8.2012288 1.2636129 ] [ 3.6752063 -0.5117859 3.5124504 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.898083421983863e-09 -8.970381340598752e-09 1.041400704365737e-09 ] [ -1.293545172676082e-09 6.058488618271273e-09 -5.75449002406406e-09 ] [ -1.013629520104996e-08 -1.559097936690578e-09 1.92496586285128e-09 ] [ 7.695960869592172e-10 -2.818741212288194e-09 -1.998620004939062e-09 ] [ -6.813823250475763e-10 -5.030113770050302e-09 -2.86535349693479e-09 ] [ 7.351380423321392e-09 1.313981704519164e-08 2.024531046121289e-09 ] [ 5.888329610476871e-09 -8.199714038350868e-10 5.627565912599609e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.414003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.950248510194106e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3330755 2.0247439 2.119411 ] [ 3.0876304 4.2399393 1.1462773 ] [ 2.3588061 4.019619 3.6824966 ] [ 5.4197688 3.2647107 1.3292628 ] [ 4.6385346 1.3861502 2.7264436 ] [ 4.7494825 4.979981 3.0705248 ] [ 4.4787531 2.9802418 4.6038798 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3330755e-10 2.0247439e-10 2.119411e-10 ] [ 3.0876304e-10 4.2399393e-10 1.1462773e-10 ] [ 2.3588061e-10 4.019619e-10 3.6824966e-10 ] [ 5.4197688e-10 3.2647107e-10 1.3292628e-10 ] [ 4.6385346e-10 1.3861502e-10 2.7264436e-10 ] [ 4.749482500000001e-10 4.979981000000001e-10 3.0705248e-10 ] [ 4.4787531e-10 2.9802418e-10 4.6038798e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.03e-05 4.1e-06 -5.5e-06 ] [ -4.6e-06 -8.5e-06 -1.1e-06 ] [ 2.4e-06 -5.1e-06 4.1e-06 ] [ -5.9e-06 -2.9e-06 1.4e-05 ] [ -9.3e-06 3.3e-06 -9.9e-06 ] [ 5.8e-06 5e-07 -7e-07 ] [ 1.3e-06 8.6e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.650241919424e-14 6.568924145279999e-15 -8.8119714144e-15 ] [ -7.370012455680001e-15 -1.36185012768e-14 -1.76239428288e-15 ] [ 3.84522388992e-15 -8.17110076608e-15 6.568924145279999e-15 ] [ -9.45284206272e-15 -4.646312200320001e-15 2.24304726912e-14 ] [ -1.490024257344e-14 5.28718284864e-15 -1.586154854592e-14 ] [ 9.292624400640001e-15 8.010883104e-16 -1.12152363456e-15 ] [ 2.08282960704e-15 1.377871893888e-14 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }