{ "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" [ [ 2.599025 3.051266 5.123232 ] [ 1.56583 2.880417 3.388537 ] [ 2.27514 4.963397 2.856014 ] [ 3.509207 1.897473 3.301843 ] [ 3.336514 3.219201 1.422465 ] [ 4.208969 3.943636 3.692529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.599025e-10 3.051266e-10 5.123232e-10 ] [ 1.56583e-10 2.880417e-10 3.388537e-10 ] [ 2.27514e-10 4.963397e-10 2.856014e-10 ] [ 3.509207e-10 1.897473e-10 3.301843e-10 ] [ 3.336514e-10 3.219201e-10 1.422465e-10 ] [ 4.208969e-10 3.943636e-10 3.692529e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1844563 36.4994815 92.2235051 ] [ -38.3908056 -19.5027902 -31.2719129 ] [ -3.7591681 8.8520125 -9.7734609 ] [ 12.3822798 -48.5337249 -56.3575656 ] [ -4.5865578 -4.9098988 -33.8876864 ] [ 33.1697955 27.5949199 39.0671206 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.897708192219271e-09 5.847861593062212e-08 1.477583437594496e-07 ] [ -6.150885118599772e-08 -3.124691449880735e-08 -5.010312773607393e-08 ] [ -6.022851243477157e-09 1.418248747452936e-08 -1.565881055828293e-08 ] [ 1.98385992077641e-08 -7.775959935511883e-08 -9.029477400952233e-08 ] [ -7.348475677107882e-09 -7.866525067853974e-09 -5.429405888308212e-08 ] [ 5.314387086681705e-08 4.421193551662868e-08 6.259242726729408e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 35.017697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.61045354476583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.836175 2.9152311 5.7442795 ] [ 0.8687133 2.8563163 3.6350338 ] [ 2.039557 5.0572905 2.4259687 ] [ 3.3725526 1.4092749 3.0463331 ] [ 3.8882876 3.3511544 1.0136587 ] [ 4.4893995 4.3661227 3.9193461 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836175e-10 2.9152311e-10 5.7442795e-10 ] [ 8.687133000000001e-11 2.8563163e-10 3.6350338e-10 ] [ 2.039557e-10 5.0572905e-10 2.4259687e-10 ] [ 3.3725526e-10 1.4092749e-10 3.0463331e-10 ] [ 3.8882876e-10 3.3511544e-10 1.0136587e-10 ] [ 4.4893995e-10 4.3661227e-10 3.9193461e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.86e-05 -3.6e-06 3.59e-05 ] [ 2.23e-05 -2.19e-05 -1.03e-05 ] [ 1.98e-05 -2.5e-06 -1.25e-05 ] [ -2.1e-05 -7.8e-06 -5.8e-06 ] [ -2.7e-05 6e-06 -2.04e-05 ] [ 2.45e-05 2.97e-05 1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.980048514688e-14 -5.76783583488e-15 5.751814068672e-14 ] [ 3.572853864384e-14 -3.508766799552e-14 -1.650241919424e-14 ] [ 3.172309709184e-14 -4.005441552e-15 -2.002720776e-14 ] [ -3.36457090368e-14 -1.249697764224e-14 -9.292624400640001e-15 ] [ -4.32587687616e-14 9.6130597248e-15 -3.268440306432e-14 ] [ 3.92533272096e-14 4.758464563776e-14 2.08282960704e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.444463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474475753941063e-18 } }