{ "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" [ [ 1.718051 2.8648 0.868268 ] [ 1.578738 2.123399 2.800363 ] [ 1.502934 5.103369 1.611601 ] [ 2.373634 3.880614 3.837999 ] [ 3.381701 1.593797 3.943141 ] [ 3.548939 3.24359 2.048233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.718051e-10 2.8648e-10 8.682680000000001e-11 ] [ 1.578738e-10 2.123399e-10 2.800363e-10 ] [ 1.502934e-10 5.103369e-10 1.611601e-10 ] [ 2.373634e-10 3.880614e-10 3.837999e-10 ] [ 3.381701e-10 1.593797e-10 3.943141e-10 ] [ 3.548939e-10 3.24359e-10 2.048233e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.885754 -4.4458537 -23.271566 ] [ -28.0129145 -25.3533642 7.0683458 ] [ -8.5157305 17.6230613 -6.0374848 ] [ -3.2083076 24.1236237 25.7066202 ] [ 11.9007435 -18.9571382 12.3098738 ] [ 35.7219631 7.0096711 -15.775789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.263437069618008e-08 -7.123042857637177e-09 -3.728515897460417e-08 ] [ -4.488163669236932e-08 -4.06205673798677e-08 1.132473838848987e-08 ] [ -1.36437043161335e-08 2.823525680178526e-08 -9.673116994995363e-09 ] [ -5.140275429054958e-09 3.865030590111679e-08 4.118654588422502e-08 ] [ 1.906709300583757e-08 -3.037268362131459e-08 1.972259200735846e-08 ] [ 5.72328941279003e-08 1.123073115591742e-08 -2.527560031047381e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.134939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.905537528543413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8621711 2.9786086 0.8106205 ] [ 1.1991472 1.3773381 2.610164 ] [ 1.384404 4.9833605 2.0177197 ] [ 2.2981798 4.4974365 4.1740861 ] [ 3.1567865 2.2901564 3.8657271 ] [ 4.2033083 2.682669 1.6312877 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8621711e-10 2.9786086e-10 8.106205e-11 ] [ 1.1991472e-10 1.3773381e-10 2.610164e-10 ] [ 1.384404e-10 4.9833605e-10 2.0177197e-10 ] [ 2.2981798e-10 4.4974365e-10 4.1740861e-10 ] [ 3.1567865e-10 2.2901564e-10 3.8657271e-10 ] [ 4.2033083e-10 2.682669e-10 1.6312877e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.43e-05 -5.8e-06 -7.1e-06 ] [ 9.4e-06 1.89e-05 4.7e-06 ] [ 1.4e-05 -5.3e-06 1.05e-05 ] [ -8.4e-06 -4.3e-06 -2.33e-05 ] [ -9.6e-06 -2.06e-05 2.44e-05 ] [ 1.89e-05 1.71e-05 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.893289188544e-14 -9.292624400640001e-15 -1.137545400768e-14 ] [ 1.506046023552e-14 3.028113813312e-14 7.53023011776e-15 ] [ 2.24304726912e-14 -8.491536090240001e-15 1.68228545184e-14 ] [ -1.345828361472e-14 -6.889359469440001e-15 -3.733071526464e-14 ] [ -1.538089555968e-14 -3.300483838848e-14 3.909310954752e-14 ] [ 3.028113813312e-14 2.739722021568e-14 -1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }