{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.413305 1.605976 1.085725 ] [ 1.596802 1.851301 3.402769 ] [ 1.403818 3.874197 1.795071 ] [ 3.61937 1.350758 2.07249 ] [ 3.606514 2.808679 3.770695 ] [ 3.997077 3.808366 1.42443 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.413305e-10 1.605976e-10 1.085725e-10 ] [ 1.596802e-10 1.851301e-10 3.402769e-10 ] [ 1.403818e-10 3.874197e-10 1.795071e-10 ] [ 3.61937e-10 1.350758e-10 2.07249e-10 ] [ 3.606514e-10 2.808679e-10 3.770695e-10 ] [ 3.997077e-10 3.808366e-10 1.42443e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7309852 0.4177435 0.429503 ] [ -0.1721367 0.6019483 -1.5959376 ] [ 2.5389765 -2.0020201 1.3221992 ] [ -1.1497417 0.8352154 -1.0564904 ] [ 0.2129546 2.1642009 -1.0658259 ] [ -2.1610379 -2.0170879 1.9665516 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.171167397590812e-09 6.692988691911648e-10 6.881396651634625e-10 ] [ -2.757933963216634e-10 9.644274931903047e-10 -2.556973910975662e-09 ] [ 4.067888789060611e-09 -3.207589798591678e-09 2.118396646280463e-09 ] [ -1.842089271698847e-09 1.33816258721212e-09 -1.69268421897964e-09 ] [ 3.411908814118157e-10 3.467432084694319e-09 -1.707641338823119e-09 ] [ -3.462364400042729e-09 -3.231731075478568e-09 3.150762997116833e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.478042 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.761596999456047e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.793525 1.9070866 0.9288521 ] [ 1.6095288 1.8904599 3.3124294 ] [ 1.3828416 3.8719871 2.0698948 ] [ 3.6165641 1.2014029 2.2112994 ] [ 3.6541303 2.9928135 3.6676383 ] [ 3.5802962 3.435527 1.3610659 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.793525e-10 1.9070866e-10 9.288521e-11 ] [ 1.6095288e-10 1.8904599e-10 3.3124294e-10 ] [ 1.3828416e-10 3.8719871e-10 2.0698948e-10 ] [ 3.616564100000001e-10 1.2014029e-10 2.2112994e-10 ] [ 3.6541303e-10 2.9928135e-10 3.6676383e-10 ] [ 3.5802962e-10 3.435527e-10 1.3610659e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 -5.89e-05 0.0001071 ] [ 6.7e-05 8.3e-05 -0.0001176 ] [ 5.79e-05 1.3e-05 2.51e-05 ] [ 1.95e-05 1.56e-05 -4.81e-05 ] [ -8.89e-05 -2.71e-05 -2.46e-05 ] [ -5.93e-05 -2.55e-05 5.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.08827115904e-15 -9.436820296512001e-14 1.7159311608768e-13 ] [ 1.073458335936e-13 1.329806595264e-13 -1.8841597060608e-13 ] [ 9.276602634432e-14 2.08282960704e-14 4.021463318208e-14 ] [ 3.12424441056e-14 2.499395528448e-14 -7.706469546047999e-14 ] [ -1.4243350158912e-13 -4.341898642368e-14 -3.941354487168e-14 ] [ -9.500907361344e-14 -4.08555038304e-14 9.308646166848001e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.223076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.201399929266158e-18 } }