{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5934083 -1.1196571 -1.5312431 ] [ 0.862759 -1.4843259 0.6811236 ] [ -1.1584458 2.2247771 -0.6786787 ] [ -0.2244957 -0.6672063 0.4394691 ] [ -0.6698985 0.3113515 0.0577451 ] [ 0.9009459 0.0551123 -1.350337 ] [ 0.8825434 0.6799484 2.381921 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.50744912681662e-10 -1.793888443712201e-09 -2.453321915793725e-09 ] [ 1.382292310573206e-09 -2.37815227422102e-09 1.091280316785962e-09 ] [ -1.856034792515437e-09 3.564485885478281e-09 -1.087363155133496e-09 ] [ -3.596817649734738e-10 -1.068982343917594e-09 7.041071233850092e-10 ] [ -1.073295723851649e-09 4.988400982608509e-10 9.251784994799339e-11 ] [ 1.4434744694781e-09 8.829963930599819e-11 -2.163478389425658e-09 ] [ 1.413990413970915e-09 1.089397438805686e-09 3.816258170233914e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.187101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.234330153039803e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1079902 3.2633837 2.5775924 ] [ 4.8025339 1.3409296 1.9077341 ] [ 3.4285024 2.7918001 0.6498054 ] [ 3.5183137 1.7742045 3.8687443 ] [ 5.5078684 3.1533371 3.2862114 ] [ 4.0975442 4.6425212 1.9950632 ] [ 3.5611902 4.1244329 4.2579884 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1079902e-10 3.2633837e-10 2.5775924e-10 ] [ 4.802533900000001e-10 1.3409296e-10 1.9077341e-10 ] [ 3.4285024e-10 2.7918001e-10 6.498054e-11 ] [ 3.5183137e-10 1.7742045e-10 3.8687443e-10 ] [ 5.507868400000001e-10 3.1533371e-10 3.2862114e-10 ] [ 4.0975442e-10 4.6425212e-10 1.9950632e-10 ] [ 3.5611902e-10 4.124432900000001e-10 4.257988400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 6.7e-06 8e-07 ] [ 8.4e-06 9.4e-06 6.4e-06 ] [ -6.7e-06 -4.6e-06 -7.5e-06 ] [ 1.6e-06 -2.6e-06 -4.1e-06 ] [ -2e-06 -2.1e-06 1.7e-06 ] [ 4.7e-06 -6.3e-06 2.5e-06 ] [ 4.4e-06 -4e-07 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6822854657e-14 1.07345834478e-14 1.2817413072e-15 ] [ 1.34582837256e-14 1.50604603596e-14 1.02539304576e-14 ] [ -1.07345834478e-14 -7.370012516399999e-15 -1.2016324755e-14 ] [ 2.5634826144e-15 -4.165659248399999e-15 -6.568924199399999e-15 ] [ -3.204353268e-15 -3.364570931399999e-15 2.7237002778e-15 ] [ 7.530230179799999e-15 -1.00937127942e-14 4.005441585e-15 ] [ 7.0495771896e-15 -6.408706536e-16 1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }