{ "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" [ [ 1.009597 0.3628337 1.078601 ] [ 0.0352367 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.0072977 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.52367e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.2977e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5953958 -17.9142289 -33.9168539 ] [ -22.619726 -27.4969969 19.7224231 ] [ -7.303765 37.8343355 2.9065072 ] [ 3.2333772 -35.0316692 5.5148078 ] [ 6.288219 8.88648 -14.376287 ] [ 18.806499 33.7220795 20.1494028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.556105851682512e-09 -2.87017587232397e-08 -5.434079036966929e-08 ] [ -3.62407961661019e-08 -4.405504557539007e-08 3.159880519634586e-08 ] [ -1.170192152681731e-08 6.061728780160349e-08 4.65673788402687e-09 ] [ 5.180441356067766e-09 -5.612692137983944e-08 8.835696125365481e-09 ] [ 1.007483746827035e-08 1.423771049720678e-08 -2.303335092531097e-08 ] [ 3.013133301689858e-08 5.402872737965896e-08 3.228290208924206e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.775977 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.886719503647852e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1159527 0.1237541 0.8028794 ] [ -0.2280863 -0.09933 2.8523636 ] [ 0.3377563 2.1749792 2.250062 ] [ 2.142235 -0.4524375 2.9796405 ] [ 2.316761 2.2245396 0.7879879 ] [ 2.6240695 1.8458907 3.1377756 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1159527e-10 1.237541e-11 8.028794e-11 ] [ -2.280863e-11 -9.933e-12 2.8523636e-10 ] [ 3.377563e-11 2.1749792e-10 2.250062e-10 ] [ 2.142235e-10 -4.524375e-11 2.9796405e-10 ] [ 2.316761e-10 2.2245396e-10 7.879879e-11 ] [ 2.6240695e-10 1.8458907e-10 3.1377756e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.62e-05 7.36e-05 4.9e-06 ] [ -2.9e-06 -1.04e-05 1.64e-05 ] [ -1.2e-06 -1.2e-05 1.19e-05 ] [ 8.3e-06 2.76e-05 1.24e-05 ] [ 1.04e-05 -4.04e-05 -7.7e-06 ] [ -4.07e-05 -3.85e-05 -3.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.197702746496e-14 1.1792019929088e-13 7.850665441919999e-15 ] [ -4.646312200320001e-15 -1.666263685632e-14 2.627569658112e-14 ] [ -1.92261194496e-15 -1.92261194496e-14 1.906590178752e-14 ] [ 1.329806595264e-14 4.422007473408001e-14 1.986699009792e-14 ] [ 1.666263685632e-14 -6.472793548032e-14 -1.233675998016e-14 ] [ -6.520858846656e-14 -6.16837999008e-14 -6.072249392832e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.800889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.85201681852559e-18 } }