{ "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" [ [ 0.8089267 0.144273 0.3085018 ] [ 0.0391703 1.366973 2.60492 ] [ 1.362051 2.292395 1.899207 ] [ 2.93764 0.2840218 0.2571454 ] [ 1.745173 0.2602682 2.163878 ] [ 2.951376 1.632187 2.170679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.089267000000001e-11 1.44273e-11 3.085018e-11 ] [ 3.91703e-12 1.366973e-10 2.60492e-10 ] [ 1.362051e-10 2.292395e-10 1.899207e-10 ] [ 2.93764e-10 2.840218e-11 2.571454e-11 ] [ 1.745173e-10 2.602682e-11 2.163878e-10 ] [ 2.951376e-10 1.632187e-10 2.170679e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5864215 -8.5599771 -14.6650626 ] [ -23.3971134 -1.7430421 11.2098628 ] [ -6.8497923 30.2920663 -2.602024 ] [ 10.4986819 -5.336585 -11.6216762 ] [ -0.4994894 -22.4947601 11.2782434 ] [ 29.8341347 7.8422981 6.4006567 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.535914040443447e-08 -1.371459518420338e-08 -2.349602044028846e-08 ] [ -3.74863080836864e-08 -2.792661301690136e-09 1.796018010053563e-08 ] [ -1.097457708039586e-08 4.853324042158356e-08 -4.168902019560499e-09 ] [ 1.682074268939612e-08 -8.550151721911969e-09 -1.861997790214779e-08 ] [ -8.002702390174196e-10 -3.604057872272467e-08 1.80697378991719e-08 ] [ 4.779955311813802e-08 1.256474666916426e-08 1.025498252250688e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.374155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.783646494715542e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5494156 0.1660958 -0.0386504 ] [ -0.0223498 0.9855582 2.0966658 ] [ 1.3737305 2.9718751 2.0283298 ] [ 2.8880023 0.4869283 -0.0588388 ] [ 1.8014578 -0.065386 3.3084425 ] [ 3.2540805 1.4350466 2.0683823 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.494156e-11 1.660958e-11 -3.865040000000001e-12 ] [ -2.23498e-12 9.855582000000001e-11 2.0966658e-10 ] [ 1.3737305e-10 2.9718751e-10 2.0283298e-10 ] [ 2.8880023e-10 4.869283e-11 -5.88388e-12 ] [ 1.8014578e-10 -6.5386e-12 3.3084425e-10 ] [ 3.2540805e-10 1.4350466e-10 2.0683823e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.1e-06 8.2e-06 6.7e-06 ] [ -3.7e-06 1.4e-06 5.8e-06 ] [ -9e-07 -8.2e-06 -1.09e-05 ] [ 3e-06 1.2e-06 -3e-07 ] [ 1e-07 -3.5e-06 -2.5e-06 ] [ -1.7e-06 9e-07 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.96674752448e-15 1.313784829056e-14 1.073458335936e-14 ] [ -5.928053496960001e-15 2.24304726912e-15 9.292624400640001e-15 ] [ -1.44195895872e-15 -1.313784829056e-14 -1.746372516672e-14 ] [ 4.8065298624e-15 1.92261194496e-15 -4.8065298624e-16 ] [ 1.6021766208e-16 -5.6076181728e-15 -4.005441552e-15 ] [ -2.72370025536e-15 1.44195895872e-15 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }