{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.8975401 -29.2872566 -5.9093436 ] [ -29.9876151 3.2893322 -30.7995053 ] [ -15.6578302 56.6358878 31.8042769 ] [ 38.635723 -40.3250591 25.0073747 ] [ 14.9072623 9.6870956 -20.1028028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.26532541100505e-08 -4.692335781189049e-08 -9.467812160194106e-09 ] [ -4.804545582676905e-08 5.27009114888463e-09 -4.934624732386569e-08 ] [ -2.508660947889619e-08 9.074069533141195e-08 5.095606889062951e-08 ] [ 6.190125211830483e-08 -6.460786692239828e-08 4.006623109192541e-08 ] [ 2.388406713719324e-08 1.552043809377455e-08 -3.220824065871278e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.718666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.999060903776385e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2286767 0.008979 1.3934967 ] [ 0.0359195 2.0723868 1.1573241 ] [ 0.7640384 2.6963497 3.2799521 ] [ 1.9224687 0.6921466 3.5093838 ] [ 1.8370236 1.5564417 -0.3028086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2286767e-10 8.978999999999999e-13 1.3934967e-10 ] [ 3.59195e-12 2.0723868e-10 1.1573241e-10 ] [ 7.640384000000001e-11 2.6963497e-10 3.2799521e-10 ] [ 1.9224687e-10 6.921466e-11 3.509383800000001e-10 ] [ 1.8370236e-10 1.5564417e-10 -3.028086e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.54e-05 -9.7e-06 9e-06 ] [ 8.2e-06 2.5e-05 -1.56e-05 ] [ -1.29e-05 -3.21e-05 1.03e-05 ] [ 1.88e-05 2.25e-05 -1.5e-06 ] [ 1.3e-06 -5.8e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.467351996032e-14 -1.554111322176e-14 1.44195895872e-14 ] [ 1.313784829056e-14 4.005441552e-14 -2.499395528448e-14 ] [ -2.066807840832e-14 -5.142986952768e-14 1.650241919424e-14 ] [ 3.012092047104e-14 3.604897396800001e-14 -2.4032649312e-15 ] [ 2.08282960704e-15 -9.292624400640001e-15 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.846255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.21841460466351e-18 } }