{ "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" [ [ 0.2934362 2.840867 1.110891 ] [ 0.7634727 2.370483 2.358735 ] [ 2.954483 0.5132865 0.5514058 ] [ 1.977096 2.170821 0.0967804 ] [ 2.774594 2.595093 2.624283 ] [ 2.05175 1.547661 1.964386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.934362e-11 2.840867e-10 1.110891e-10 ] [ 7.634727e-11 2.370483e-10 2.358735e-10 ] [ 2.954483e-10 5.132865e-11 5.514058e-11 ] [ 1.977096e-10 2.170821e-10 9.67804e-12 ] [ 2.774594e-10 2.595093e-10 2.624283e-10 ] [ 2.05175e-10 1.547661e-10 1.964386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.7382787 17.8167926 -40.4742438 ] [ -11.1586001 -2.1474774 48.212573 ] [ 6.7426326 -9.7976771 -7.062462 ] [ 1.3742727 3.8239995 -14.666204 ] [ 29.6123879 33.2066897 25.841417 ] [ -3.8324145 -42.9023273 -11.8510803 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.643073853037462e-08 2.854564856136245e-08 -6.484688716091936e-08 ] [ -1.787804820107654e-08 -3.44063808397637e-09 7.724505728921332e-08 ] [ 1.080288831436392e-08 -1.569760918776754e-08 -1.131531150168841e-08 ] [ 2.201827590543692e-09 6.12672259685089e-09 -2.349784916468345e-08 ] [ 4.744427557944081e-08 5.320298189150017e-08 4.140251416574368e-08 ] [ -6.140204913114922e-09 -6.87371057779696e-08 -1.898752378788345e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.819129 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.015156850761929e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0495216 2.9920733 0.4958961 ] [ 0.5257215 2.3943983 2.7119859 ] [ 2.7937439 0.5129697 0.3503111 ] [ 1.823672 2.3425862 -0.8365272 ] [ 3.3485491 2.8626057 3.3761004 ] [ 2.3726669 0.9335784 2.6087149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.95216e-12 2.9920733e-10 4.958961e-11 ] [ 5.257215e-11 2.3943983e-10 2.7119859e-10 ] [ 2.7937439e-10 5.129697e-11 3.503111e-11 ] [ 1.823672e-10 2.3425862e-10 -8.365272000000001e-11 ] [ 3.3485491e-10 2.8626057e-10 3.3761004e-10 ] [ 2.3726669e-10 9.335784000000001e-11 2.6087149e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.69e-05 -2.98e-05 -1.75e-05 ] [ 2.52e-05 2.93e-05 1.29e-05 ] [ 9.6e-06 1.94e-05 -2.42e-05 ] [ 1.65e-05 7.8e-06 1.64e-05 ] [ -2.19e-05 -6.49e-05 -3.66e-05 ] [ -2.6e-06 3.81e-05 4.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.309855109952001e-14 -4.774486329984001e-14 -2.8038090864e-14 ] [ 4.037485084416e-14 4.694377498944e-14 2.066807840832e-14 ] [ 1.538089555968e-14 3.108222644352e-14 -3.877267422336e-14 ] [ 2.64359142432e-14 1.249697764224e-14 2.627569658112e-14 ] [ -3.508766799552e-14 -1.0398126268992e-13 -5.863966432128e-14 ] [ -4.16565921408e-15 6.104292925248e-14 7.85066544192e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.839589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.697999579968085e-18 } }