{ "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" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1289229 -4.5691505 1.6100396 ] [ 0.5248256 5.496582 -1.7361047 ] [ 0.6249454 -1.0862232 1.2359642 ] [ 3.750863 1.633153 2.1151952 ] [ -0.5647543 0.0947669 -2.7161929 ] [ -1.206957 -1.5691281 -0.5089014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.013087118665736e-09 -7.320586108016631e-09 2.579567805682183e-09 ] [ 8.408633063173326e-10 8.806495174710106e-09 -2.781546361600998e-09 ] [ 1.001272909156504e-09 -1.740321416010563e-09 1.980232945385775e-09 ] [ 6.00954500642375e-09 2.616599554789382e-09 3.38891629786838e-09 ] [ -9.048361359562695e-10 1.518333116056915e-10 -4.351820761962951e-09 ] [ -1.933758287710906e-09 -2.514020356860325e-09 -8.15349925372389e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.986851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.56137589124131e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0787298 0.3103842 0.7403233 ] [ 0.3308416 2.6996663 0.6526377 ] [ 0.2195675 1.5798275 2.7771346 ] [ 2.4153816 0.0635324 0.7325898 ] [ 2.5562232 1.3329598 2.7694083 ] [ 2.6674981 2.4528128 0.6449191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.87298e-12 3.103842e-11 7.403233e-11 ] [ 3.308416e-11 2.6996663e-10 6.526377e-11 ] [ 2.195675e-11 1.5798275e-10 2.7771346e-10 ] [ 2.4153816e-10 6.353240000000001e-12 7.325898e-11 ] [ 2.5562232e-10 1.3329598e-10 2.7694083e-10 ] [ 2.6674981e-10 2.4528128e-10 6.449190999999999e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.02e-05 -1.62e-05 -1.38e-05 ] [ 4.5e-06 1.65e-05 -1.5e-05 ] [ -9e-06 -2.13e-05 3.35e-05 ] [ 4.69e-05 -3.79e-05 -1.13e-05 ] [ 4.2e-06 9.4e-06 4.79e-05 ] [ 3.35e-05 4.95e-05 -4.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2849456498816e-13 -2.595526125696e-14 -2.211003736704e-14 ] [ 7.2097947936e-15 2.64359142432e-14 -2.4032649312e-14 ] [ -1.44195895872e-14 -3.412636202304e-14 5.36729167968e-14 ] [ 7.514208351552e-14 -6.072249392832e-14 -1.810459581504e-14 ] [ 6.72914180736e-15 1.506046023552e-14 7.674426013632e-14 ] [ 5.36729167968e-14 7.930774272959999e-14 -6.616989443904001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.816992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.014814465618063e-18 } }