{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6638351 -2.4419848 -12.6351206 ] [ -1.4135436 1.8732181 7.027701 ] [ -0.6575196 -7.2021433 0.4891552 ] [ -3.7176264 8.4247377 -0.8167606 ] [ 10.4525248 -0.6538276 5.9350249 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.472287622049053e-09 -3.912490987143163e-09 -2.024369499309206e-08 ] [ -2.264746527060242e-09 3.001226270205875e-09 1.125961833293843e-08 ] [ -1.053462539517026e-09 -1.153910570997965e-08 7.837130318395968e-10 ] [ -5.956294152021537e-09 1.34979178905189e-08 -1.30859474889182e-09 ] [ 1.674679100086552e-08 -1.047547303384298e-09 9.508958216988186e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.044096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.128588601885286e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7055228 2.479095 -0.4109205 ] [ 2.7106546 4.0939151 3.2234794 ] [ 3.1917058 0.8198014 0.7995488 ] [ 1.4077406 4.5023535 1.0874025 ] [ 3.8154932 1.8191648 3.0444099 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7055228e-10 2.479095e-10 -4.109205e-11 ] [ 2.7106546e-10 4.0939151e-10 3.2234794e-10 ] [ 3.1917058e-10 8.198014e-11 7.995487999999999e-11 ] [ 1.4077406e-10 4.5023535e-10 1.0874025e-10 ] [ 3.8154932e-10 1.8191648e-10 3.0444099e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 -1.57e-05 5.9e-06 ] [ 9.6e-06 9.1e-06 -2.3e-06 ] [ 1.83e-05 2e-07 -4.1e-06 ] [ -1.45e-05 2.41e-05 2.1e-06 ] [ -1.39e-05 -1.76e-05 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706536e-16 -2.515417315379999e-14 9.452842140600001e-15 ] [ 1.53808956864e-14 1.45798073694e-14 -3.685006258199999e-15 ] [ 2.93198324022e-14 3.204353268e-16 -6.568924199399999e-15 ] [ -2.3231561193e-14 3.86124568794e-14 3.364570931399999e-15 ] [ -2.22702552126e-14 -2.81983087584e-14 -2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.716098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.197561172525413e-18 } }