{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4159758 -0.8746998 0.2553597 ] [ 0.5089825 -1.5407682 -1.501499 ] [ 0.429788 1.7084504 -0.2875485 ] [ -0.2827321 2.0372478 -0.7419415 ] [ 1.7599374 -1.3302301 2.2756293 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.870819975069456e-09 -1.401423581324473e-09 4.091313446052498e-10 ] [ 8.154798686149049e-10 -2.468582808450239e-09 -2.405666613774366e-09 ] [ 6.88596291173592e-10 2.737239311227953e-09 -4.607034878417489e-10 ] [ -4.529867643017513e-10 3.264030822827905e-09 -1.188721335094911e-09 ] [ 2.819730579582712e-09 -2.131263584063483e-09 3.645960092105775e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.134615 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104397324958591e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4412791 2.3026564 1.3295743 ] [ 2.2782647 4.2801382 2.8005927 ] [ 4.3956412 5.5290936 2.5603176 ] [ 3.4838684 4.4049993 0.5588217 ] [ 4.4932516 3.0624806 2.4754298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4412791e-10 2.3026564e-10 1.3295743e-10 ] [ 2.2782647e-10 4.2801382e-10 2.8005927e-10 ] [ 4.3956412e-10 5.5290936e-10 2.5603176e-10 ] [ 3.4838684e-10 4.4049993e-10 5.588217e-11 ] [ 4.4932516e-10 3.0624806e-10 2.4754298e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -1.22e-05 3.4e-06 ] [ -1.49e-05 1.07e-05 2.4e-06 ] [ 3.7e-06 -8e-06 3.2e-06 ] [ -8e-07 1.16e-05 -1.03e-05 ] [ 1.26e-05 -2.1e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999998e-16 -1.95465549348e-14 5.4474005556e-15 ] [ -2.38724318466e-14 1.71432899838e-14 3.845223921599999e-15 ] [ 5.9280535458e-15 -1.2817413072e-14 5.1269652288e-15 ] [ -1.2817413072e-15 1.85852489544e-14 -1.65024193302e-14 ] [ 2.01874255884e-14 -3.364570931399999e-15 1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }