{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.473601 0.758206 0.3241046 ] [ 0.6605978 0.3280983 2.253004 ] [ 1.152363 2.280508 2.499358 ] [ 2.483173 0.1660582 2.77941 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.473601e-10 7.582060000000001e-11 3.241046e-11 ] [ 6.605978e-11 3.280983e-11 2.253004e-10 ] [ 1.152363e-10 2.280508e-10 2.499358e-10 ] [ 2.483173e-10 1.660582e-11 2.77941e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0246939 0.2932614 -6.4800559 ] [ -10.9593992 -6.0897787 0.5202261 ] [ -0.1950562 9.3060163 1.7178627 ] [ 10.1297616 -3.5094991 4.2419672 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.641740610056373e-09 4.698565588630771e-10 -1.03821940644571e-08 ] [ -1.755889317625423e-08 -9.756901058985817e-09 8.334940949499629e-10 ] [ -3.12514483382089e-10 1.490988174864372e-08 2.752319455684365e-09 ] [ 1.62296672097976e-08 -5.622837408738642e-09 6.796380674040439e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1247936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.608647871545467e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6546616 0.8483868 0.4083701 ] [ 0.1573385 0.0606344 2.3354956 ] [ 1.2660756 2.3708795 2.4350392 ] [ 2.6916591 0.2529697 2.6769717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6546616e-10 8.483868e-11 4.083701e-11 ] [ 1.573385e-11 6.06344e-12 2.3354956e-10 ] [ 1.2660756e-10 2.3708795e-10 2.4350392e-10 ] [ 2.6916591e-10 2.529697e-11 2.6769717e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 -1.2e-06 -1.59e-05 ] [ -1.01e-05 -2.4e-06 1.07e-05 ] [ -3.8e-06 4.8e-06 6.5e-06 ] [ 3.1e-06 -1.3e-06 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.730350750464e-14 -1.92261194496e-15 -2.547460827072e-14 ] [ -1.618198387008e-14 -3.84522388992e-15 1.714328984256e-14 ] [ -6.08827115904e-15 7.69044777984e-15 1.04141480352e-14 ] [ 4.96674752448e-15 -2.08282960704e-15 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.2543154 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.32248711545894e-18 } }