{ "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" [ [ 2.786609 1.867113 1.082186 ] [ 2.283835 1.161691 2.913478 ] [ 2.881264 2.452205 4.60424 ] [ 1.739559 3.43443 2.357326 ] [ 4.554937 2.252479 3.113794 ] [ 4.190396 3.99304 2.000834 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.786609e-10 1.867113e-10 1.082186e-10 ] [ 2.283835e-10 1.161691e-10 2.913478e-10 ] [ 2.881264e-10 2.452205e-10 4.60424e-10 ] [ 1.739559e-10 3.43443e-10 2.357326e-10 ] [ 4.554937e-10 2.252479e-10 3.113794e-10 ] [ 4.190396e-10 3.99304e-10 2.000834e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.6632561 8.3160886 -23.4764992 ] [ -6.9563795 -30.8977291 18.7632167 ] [ -2.6917755 6.0111459 12.9145951 ] [ -6.4880138 16.9719314 -2.9081182 ] [ 11.0214081 -15.8465957 5.9086431 ] [ -2.5484953 15.4451589 -11.2018375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.227788986377797e-08 1.332384284119377e-08 -3.761349846635969e-08 ] [ -1.11453486921366e-08 -4.950361960768185e-08 3.006198737541859e-08 ] [ -4.312699810073667e-09 9.630917504544898e-09 2.069146250679089e-08 ] [ -1.039494411142955e-08 2.71920319229309e-08 -4.659319028950139e-09 ] [ 1.765824253159833e-08 -2.538904535898487e-08 9.466689913465324e-09 ] [ -4.08313962151882e-09 2.474587269799714e-08 -1.794732230036497e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7657415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.23773630898411e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0759728 1.9170469 0.7849503 ] [ 2.1141737 0.8124153 2.9946456 ] [ 2.7775541 2.6695111 4.8382218 ] [ 1.7210362 3.5435018 2.5985319 ] [ 4.6296286 2.0091754 3.0975063 ] [ 4.1182346 4.2093076 1.758002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0759728e-10 1.9170469e-10 7.849503e-11 ] [ 2.1141737e-10 8.124153e-11 2.9946456e-10 ] [ 2.7775541e-10 2.6695111e-10 4.838221800000001e-10 ] [ 1.7210362e-10 3.5435018e-10 2.5985319e-10 ] [ 4.6296286e-10 2.0091754e-10 3.0975063e-10 ] [ 4.1182346e-10 4.2093076e-10 1.758002e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.69e-05 -2.95e-05 -4.71e-05 ] [ 8.7e-06 2.7e-06 1.07e-05 ] [ 5.3e-06 -8e-07 4.13e-05 ] [ -3.16e-05 2.74e-05 -3.61e-05 ] [ 2.58e-05 8.5e-06 -1.44e-05 ] [ 8.7e-06 -8.2e-06 4.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.70767851146e-14 -4.726421070299999e-14 -7.546251946139999e-14 ] [ 1.39389367158e-14 4.3258769118e-15 1.71432899838e-14 ] [ 8.4915361602e-15 -1.2817413072e-15 6.61698949842e-14 ] [ -5.06287816344e-14 4.389963977159999e-14 -5.783857648740001e-14 ] [ 4.133615715719999e-14 1.3618501389e-14 -2.30713435296e-14 ] [ 1.39389367158e-14 -1.31378483988e-14 7.30592545104e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.864633 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.182665083558532e-18 } }