{ "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" [ [ 2.009011 2.631584 2.068402 ] [ 2.205606 1.805457 4.240805 ] [ 0.8880067 3.587298 3.588265 ] [ 4.034619 2.466924 2.718393 ] [ 3.26703 4.599532 3.000235 ] [ 4.036538 3.227395 4.622039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.009011e-10 2.631584e-10 2.068402e-10 ] [ 2.205606e-10 1.805457e-10 4.240805e-10 ] [ 8.880067e-11 3.587298e-10 3.588265e-10 ] [ 4.034619000000001e-10 2.466924e-10 2.718393e-10 ] [ 3.26703e-10 4.599532e-10 3.000235e-10 ] [ 4.036538e-10 3.227395e-10 4.622039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0170629 -0.7033055 -3.1575971 ] [ -0.0724868 -1.0781436 0.7972523 ] [ -1.0232405 1.6848172 1.4321064 ] [ 2.3561255 -2.3980429 -3.2857106 ] [ -1.0807029 1.3433735 -0.6633206 ] [ 0.8373676 1.1513013 4.8772696 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.629514400263048e-09 -1.126819629380055e-09 -5.059028251525879e-09 ] [ -1.161366562766055e-10 -1.727376469785147e-09 1.277338995939028e-09 ] [ -1.639412006555703e-09 2.699374728161718e-09 2.294487392578053e-09 ] [ 3.774929191770711e-09 -3.842088270055432e-09 -5.26428870603474e-09 ] [ -1.73147692041076e-09 2.152321614702269e-09 -1.062756757415029e-09 ] [ 1.341610791735406e-09 1.844588026356647e-09 7.814247326458569e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.831493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.536484795695885e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.904335 2.660441 1.9307598 ] [ 2.2948517 1.5410306 4.0426413 ] [ 1.3132598 3.7548408 4.0088745 ] [ 4.1670105 2.3512239 2.7371717 ] [ 3.1854189 4.5650326 2.7034051 ] [ 3.5759349 3.445621 4.8152866 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.904335e-10 2.660441e-10 1.9307598e-10 ] [ 2.2948517e-10 1.5410306e-10 4.0426413e-10 ] [ 1.3132598e-10 3.7548408e-10 4.0088745e-10 ] [ 4.1670105e-10 2.3512239e-10 2.7371717e-10 ] [ 3.1854189e-10 4.565032600000001e-10 2.7034051e-10 ] [ 3.5759349e-10 3.445621e-10 4.8152866e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 3.9e-06 2.8e-06 ] [ 6.3e-06 -6e-06 -5.9e-06 ] [ 6.3e-06 1.2e-06 -1.7e-05 ] [ -3.9e-06 -7.2e-06 1.46e-05 ] [ -9.6e-06 6.6e-06 4.9e-06 ] [ 1.13e-05 1.5e-06 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 6.24848882112e-15 4.48609453824e-15 ] [ 1.009371271104e-14 -9.6130597248e-15 -9.45284206272e-15 ] [ 1.009371271104e-14 1.92261194496e-15 -2.72370025536e-14 ] [ -6.24848882112e-15 -1.153567166976e-14 2.339177866368e-14 ] [ -1.538089555968e-14 1.057436569728e-14 7.850665441919999e-15 ] [ 1.810459581504e-14 2.4032649312e-15 1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199746772493e-18 } }