{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.97529 -4.8972956 -14.9934041 ] [ -24.7877684 -17.9567497 42.8924747 ] [ 9.1193577 -20.5787647 -15.3029563 ] [ -20.8180934 38.7856662 -51.5893812 ] [ 61.4617941 4.6471437 38.9932669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.001482573570003e-08 -7.846332515466707e-09 -2.402208151522686e-08 ] [ -3.971438301228503e-08 -2.876988455489741e-08 6.872132017259549e-08 ] [ 1.461082170365246e-08 -3.297081568728433e-08 -2.451803881298407e-08 ] [ -3.335426253511078e-08 6.214148760779279e-08 -8.265530044017905e-08 ] [ 9.847264957944338e-08 7.445544989638008e-09 6.247410059579449e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.233752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.324634047586525e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0354653 1.3152933 0.9755221 ] [ 1.0381899 1.1534785 3.1841821 ] [ 2.831019 0.2071325 -0.4827309 ] [ 1.9581017 2.4586067 0.1318123 ] [ 3.0903357 2.1702936 2.2831449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.54653e-12 1.3152933e-10 9.755221e-11 ] [ 1.0381899e-10 1.1534785e-10 3.1841821e-10 ] [ 2.831019e-10 2.071325e-11 -4.827309000000001e-11 ] [ 1.9581017e-10 2.4586067e-10 1.318123e-11 ] [ 3.0903357e-10 2.1702936e-10 2.2831449e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.5e-06 2.4e-06 1.52e-05 ] [ -2.62e-05 3.1e-06 4.7e-06 ] [ 9.4e-06 1.65e-05 -1.89e-05 ] [ -1.09e-05 -2.62e-05 -3.18e-05 ] [ 3.52e-05 4.2e-06 3.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2016324656e-14 3.84522388992e-15 2.435308463616e-14 ] [ -4.197702746496e-14 4.96674752448e-15 7.53023011776e-15 ] [ 1.506046023552e-14 2.64359142432e-14 -3.028113813312e-14 ] [ -1.746372516672e-14 -4.197702746496e-14 -5.094921654144e-14 ] [ 5.639661705216e-14 6.72914180736e-15 4.934703992064001e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927010881090069e-18 } }