{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0463348 -1.5948214 -2.3887114 ] [ -1.9344921 -1.6724113 3.873273 ] [ 5.7081066 1.9119603 -0.1701898 ] [ 2.001391 -0.1095772 1.0720134 ] [ 5.3022663 2.2733165 -4.2125211 ] [ 1.0825615 3.8417912 0.305129 ] [ -8.1134985 -4.650258 1.5210068 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.482943069901063e-09 -2.555185582483168e-09 -3.827137590449427e-09 ] [ -3.099398041277591e-09 -2.679498307297564e-09 6.205667497703082e-09 ] [ 9.145395018901183e-09 3.06329811779563e-09 -2.726741209051332e-10 ] [ 3.206581895697893e-09 -1.755620294591448e-10 1.717554820814895e-09 ] [ 8.495167173105633e-09 3.642254577986661e-09 -6.749202876651977e-09 ] [ 1.734454740167991e-09 6.15522809334682e-09 4.88870554155786e-10 ] [ -1.299925771669405e-08 -7.450534709671572e-09 2.436921555115111e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.574431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.456604924004525e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4583324 2.3285983 2.4654973 ] [ 2.2264996 1.3268512 4.6469588 ] [ 2.5619819 4.5633743 2.125215 ] [ 2.0214122 3.832701 4.470844 ] [ 3.7227003 1.2758179 2.6193646 ] [ 4.2857624 2.7798887 4.6247344 ] [ 4.7583792 3.5422047 2.274507 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4583324e-10 2.3285983e-10 2.4654973e-10 ] [ 2.2264996e-10 1.3268512e-10 4.6469588e-10 ] [ 2.5619819e-10 4.563374300000001e-10 2.125215e-10 ] [ 2.0214122e-10 3.832701e-10 4.470844e-10 ] [ 3.7227003e-10 1.2758179e-10 2.6193646e-10 ] [ 4.2857624e-10 2.7798887e-10 4.6247344e-10 ] [ 4.7583792e-10 3.5422047e-10 2.274507e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.6e-06 9.7e-06 -2e-07 ] [ 1.91e-05 8.6e-06 2.06e-05 ] [ 1.5e-05 -5.5e-06 2.28e-05 ] [ -3.8e-06 -1.48e-05 -1.78e-05 ] [ -1.13e-05 -1.4e-05 -1.9e-05 ] [ -2.97e-05 1e-05 8.6e-06 ] [ 1.1e-06 6e-06 -1.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.53808956864e-14 1.55411133498e-14 -3.204353268e-16 ] [ 3.06015737094e-14 1.37787190524e-14 3.300483866039999e-14 ] [ 2.403264951e-14 -8.811971486999999e-15 3.65296272552e-14 ] [ -6.088271209199999e-15 -2.37122141832e-14 -2.851874408519999e-14 ] [ -1.81045959642e-14 -2.243047287599999e-14 -3.0441356046e-14 ] [ -4.75846460298e-14 1.602176634e-14 1.37787190524e-14 ] [ 1.7623942974e-15 9.613059803999999e-15 -2.403264951e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.011241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.007242591754279e-18 } }