{ "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" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7749935 -0.5267632 7.3135898 ] [ -3.7382813 3.4730745 -2.7543483 ] [ 10.2842093 12.522983 -18.8396849 ] [ -8.190826 -19.4026633 13.4861113 ] [ 4.4198915 3.933369 0.7943321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.446029745201879e-09 -8.439676906910687e-10 1.171766268822073e-08 ] [ -5.989386950179143e-09 5.564478812041232e-09 -4.412952488157623e-09 ] [ 1.64771198396255e-08 2.006403075057922e-08 -3.018450293870263e-08 ] [ -1.312315003035968e-08 -3.108649377662933e-08 2.160713240838336e-08 ] [ 7.08144688611521e-09 6.301951904699945e-09 1.272660330256151e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.5094171673103272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.418352916423075e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9321172 1.6042405 2.8036442 ] [ 0.2198782 2.4020074 0.6745284 ] [ 2.2288155 1.3586064 -0.068665 ] [ 1.4896863 -0.2957399 1.4784866 ] [ 3.0318298 2.338004 1.9494518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.321172e-11 1.6042405e-10 2.8036442e-10 ] [ 2.198782e-11 2.4020074e-10 6.745284000000001e-11 ] [ 2.2288155e-10 1.3586064e-10 -6.8665e-12 ] [ 1.4896863e-10 -2.957399e-11 1.4784866e-10 ] [ 3.0318298e-10 2.338004e-10 1.9494518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -4.4e-06 -8.8e-06 ] [ 1e-06 -3.6e-06 -1e-07 ] [ -7.8e-06 -2.8e-06 7.5e-06 ] [ 1.17e-05 2.91e-05 2.4e-06 ] [ -5e-06 -1.83e-05 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-16 -7.0495771896e-15 -1.40991543792e-14 ] [ 1.602176634e-15 -5.767835882399999e-15 -1.602176634e-16 ] [ -1.24969777452e-14 -4.486094575199999e-15 1.2016324755e-14 ] [ 1.87454666178e-14 4.66233400494e-14 3.845223921599999e-15 ] [ -8.010883169999999e-15 -2.93198324022e-14 -1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }