{ "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" [ [ 0.9163946 0.5446671 1.49786 ] [ 0.0084298 2.294234 2.779305 ] [ 1.912564 0.4098673 0.1717336 ] [ 2.851379 0.2549877 2.412214 ] [ 1.718971 2.318251 1.204915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.163945999999999e-11 5.446671e-11 1.49786e-10 ] [ 8.4298e-13 2.294234e-10 2.779305e-10 ] [ 1.912564e-10 4.098673e-11 1.717336e-11 ] [ 2.851379e-10 2.549877e-11 2.412214e-10 ] [ 1.718971e-10 2.318251e-10 1.204915e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8696648 -12.958986 2.0319973 ] [ -4.9984082 4.6580231 5.222786 ] [ 6.2962158 -2.2702419 -6.0425858 ] [ 8.1493987 -2.2580688 2.2515482 ] [ 6.4224585 12.8292737 -3.4637457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.542600613197228e-08 -2.076258456953312e-08 3.255618594411088e-09 ] [ -8.008332825233998e-09 7.462975771452244e-09 8.367825693582324e-09 ] [ 1.008764983738162e-08 -3.637328525707764e-09 -9.681289777700196e-09 ] [ 1.305677617828998e-08 -3.617825069324419e-09 3.607377916364759e-09 ] [ 1.028991294153469e-08 2.055476255333073e-08 -5.549532426657973e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.84378684 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.351895559124697e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.605505 0.0405276 1.6169194 ] [ 0.0337546 2.2451321 2.649969 ] [ 1.8791602 0.641217 0.3186314 ] [ 3.0817191 -0.1838172 2.6248382 ] [ 1.8075996 3.0789475 0.8556696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.05505e-11 4.05276e-12 1.6169194e-10 ] [ 3.37546e-12 2.2451321e-10 2.649969e-10 ] [ 1.8791602e-10 6.41217e-11 3.186314e-11 ] [ 3.0817191e-10 -1.838172e-11 2.6248382e-10 ] [ 1.8075996e-10 3.0789475e-10 8.556696000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.57e-05 6.01e-05 -3.68e-05 ] [ 2.92e-05 -2.43e-05 3e-07 ] [ -3.8e-06 -1.01e-05 9.11e-05 ] [ -5.33e-05 -8.6e-06 -3.15e-05 ] [ -3.78e-05 -1.71e-05 -2.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.052630048538e-13 9.629081570339999e-14 -5.896010013119999e-14 ] [ 4.67835577128e-14 -3.893289220619999e-14 4.806529901999999e-16 ] [ -6.088271209199999e-15 -1.61819840034e-14 1.459582913574e-13 ] [ -8.53960145922e-14 -1.37787190524e-14 -5.046856397099999e-14 ] [ -6.056227676519999e-14 -2.73972204414e-14 -3.70102802454e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.282995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.807735095053883e-18 } }