{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.177844 -2.6119686 0.1979041 ] [ -3.4321618 -13.3187056 2.1644507 ] [ -6.9701575 4.2476455 5.7583725 ] [ -3.6205377 8.4133921 -0.8896049 ] [ 3.6351452 -2.5127899 -5.4212402 ] [ 5.4864597 -2.6933103 2.5705984 ] [ 3.7234081 8.4757367 -4.3804807 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.887114135297096e-09 -4.184835059661692e-09 3.170773247927994e-10 ] [ -5.498929440067381e-09 -2.133891890744495e-08 3.467832336984943e-09 ] [ -1.116742348179985e-08 6.805478369615246e-09 9.225929869368164e-09 ] [ -5.800740905456101e-09 1.347974023530019e-08 -1.425304184271906e-09 ] [ 5.824144700637256e-09 -4.025933263931196e-09 -8.685784375741486e-09 ] [ 8.790277534722649e-09 -4.315158830771529e-09 4.118552691877785e-09 ] [ 5.965557456666334e-09 1.357962729667627e-08 -7.018303823227962e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.211559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.917813429851241e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5760024 1.2712785 1.9264107 ] [ 2.4989609 0.3307519 4.0348364 ] [ 2.4439423 2.7041553 5.0433641 ] [ 1.5235965 3.5329464 2.8874652 ] [ 4.0442248 1.1466999 2.1988806 ] [ 4.578532 1.5500101 4.5774317 ] [ 3.9892261 3.5201167 3.2074033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5760024e-10 1.2712785e-10 1.9264107e-10 ] [ 2.4989609e-10 3.307519e-11 4.0348364e-10 ] [ 2.4439423e-10 2.7041553e-10 5.0433641e-10 ] [ 1.5235965e-10 3.5329464e-10 2.8874652e-10 ] [ 4.0442248e-10 1.1466999e-10 2.1988806e-10 ] [ 4.578532e-10 1.5500101e-10 4.5774317e-10 ] [ 3.9892261e-10 3.5201167e-10 3.2074033e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.77e-05 -1.4e-06 6.2e-06 ] [ 2.74e-05 -7.38e-05 2.95e-05 ] [ 0.0001123 8.3e-06 2.3e-06 ] [ 6.84e-05 -2.46e-05 -0.0001213 ] [ -0.0001281 0.0001935 0.0001159 ] [ -5.78e-05 -2.9e-05 -5.86e-05 ] [ -5.99e-05 -7.29e-05 2.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.040205910179999e-14 -2.2430472876e-15 9.9334951308e-15 ] [ 4.389963977159999e-14 -1.182406355892e-13 4.726421070299999e-14 ] [ 1.799244359982e-13 1.32980660622e-14 3.685006258199999e-15 ] [ 1.095888817656e-13 -3.94135451964e-14 -1.943440257042e-13 ] [ -2.052388268154e-13 3.100211786789999e-13 1.856922718806e-13 ] [ -9.26058094452e-14 -4.6463122386e-14 -9.38875507524e-14 ] [ -9.597038037659999e-14 -1.167986766186e-13 4.165659248399999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.410211 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.590511642720977e-18 } }