{ "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" [ [ 1.98485 2.119324 1.827991 ] [ 0.9744942 2.30107 3.805126 ] [ 2.339547 3.991011 2.574302 ] [ 4.37234 1.986188 1.289197 ] [ 3.548577 1.396458 3.420144 ] [ 4.317537 3.428201 2.979668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.98485e-10 2.119324e-10 1.827991e-10 ] [ 9.744942e-11 2.30107e-10 3.805126e-10 ] [ 2.339547e-10 3.991011e-10 2.574302e-10 ] [ 4.37234e-10 1.986188e-10 1.289197e-10 ] [ 3.548577e-10 1.396458e-10 3.420144e-10 ] [ 4.317537e-10 3.428201e-10 2.979668e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.124973 -60.981654 -44.0895617 ] [ -11.5928495 -0.5707915 19.37211 ] [ -22.7982428 74.2605749 14.3726374 ] [ 8.8794996 -8.2165672 -31.6293944 ] [ -8.9940732 -25.3812135 23.2335608 ] [ 42.630639 20.8896513 18.7406479 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.301764178523124e-08 -9.770338033651481e-08 -7.06392649770591e-08 ] [ -1.857379243735297e-08 -9.145087966513632e-10 3.103754173756589e-08 ] [ -3.652681160948193e-08 1.189785569519473e-07 2.30275036215157e-08 ] [ 1.422652666352295e-08 -1.316439187107212e-08 -5.067587623774244e-08 ] [ -1.441009380680384e-08 -4.066518687723334e-08 3.722426793169534e-08 ] [ 6.830181313556469e-08 3.346891092952433e-08 3.002582792402462e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.7270644 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.238012192909598e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9087818 2.0111804 1.3977161 ] [ 1.0576689 2.2567573 3.9758293 ] [ 2.0798895 4.3160392 2.7083159 ] [ 4.5072119 1.7645138 1.1627406 ] [ 3.4557417 1.2591807 3.6265627 ] [ 4.5280513 3.6145806 3.0252633 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9087818e-10 2.0111804e-10 1.3977161e-10 ] [ 1.0576689e-10 2.2567573e-10 3.9758293e-10 ] [ 2.0798895e-10 4.3160392e-10 2.7083159e-10 ] [ 4.5072119e-10 1.7645138e-10 1.1627406e-10 ] [ 3.4557417e-10 1.2591807e-10 3.6265627e-10 ] [ 4.5280513e-10 3.6145806e-10 3.0252633e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.02e-05 5e-06 -3.38e-05 ] [ -9.4e-06 -1.6e-05 2.36e-05 ] [ 1.01e-05 8e-06 -8e-06 ] [ 7.2e-06 -4.2e-06 -2.35e-05 ] [ -3.1e-06 -6.8e-06 3.49e-05 ] [ 5.5e-06 1.4e-05 6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.634220153216e-14 8.010883104e-15 -5.415356978304e-14 ] [ -1.506046023552e-14 -2.56348259328e-14 3.781136825088e-14 ] [ 1.618198387008e-14 1.28174129664e-14 -1.28174129664e-14 ] [ 1.153567166976e-14 -6.72914180736e-15 -3.76511505888e-14 ] [ -4.96674752448e-15 -1.089480102144e-14 5.591596406592e-14 ] [ 8.8119714144e-15 2.24304726912e-14 1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.70725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.31766718310608e-18 } }