{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.2834305 -18.7920803 -3.0639682 ] [ -10.2313883 2.1847309 16.0158207 ] [ -8.6274222 3.8619404 -13.4277859 ] [ -3.571415 5.7610185 0.115816 ] [ 12.1312754 4.641767 -15.3728976 ] [ 17.5823806 2.3426236 15.733015 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.166934206632165e-08 -3.010823171285625e-08 -4.909018216914659e-09 ] [ -1.639249113258666e-08 3.500324770719343e-09 2.566017348846469e-08 ] [ -1.38226541466109e-08 6.187510619803001e-09 -2.151368463808789e-08 ] [ -5.722037616174433e-09 9.230169152696284e-09 1.855576875145728e-10 ] [ 1.943644582636617e-08 7.436930566600953e-09 -2.463009712867243e-08 ] [ 2.817007913532748e-08 3.753296763254331e-09 2.520706880769571e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.8189037 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.720734846026617e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9423517 -0.1524523 1.5046878 ] [ 0.7326515 1.5469353 3.2141335 ] [ 0.7788715 1.4836953 -0.1137146 ] [ -0.0906475 2.9291173 1.455995 ] [ 3.0163736 1.9598479 0.1622555 ] [ 3.0174358 0.8341756 2.2627702 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.423517e-11 -1.524523e-11 1.5046878e-10 ] [ 7.326515e-11 1.5469353e-10 3.2141335e-10 ] [ 7.788715000000001e-11 1.4836953e-10 -1.137146e-11 ] [ -9.064750000000001e-12 2.9291173e-10 1.455995e-10 ] [ 3.0163736e-10 1.9598479e-10 1.622555e-11 ] [ 3.0174358e-10 8.341756000000001e-11 2.2627702e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 1.12e-05 -4.5e-06 ] [ -2.5e-06 2e-06 4.5e-06 ] [ -1.5e-06 -4.6e-06 -4.5e-06 ] [ -1.3e-06 -5.7e-06 3.6e-06 ] [ 3.1e-06 -2.6e-06 1.9e-06 ] [ 4.6e-06 -2e-07 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 1.794437815296e-14 -7.2097947936e-15 ] [ -4.005441552e-15 3.2043532416e-15 7.2097947936e-15 ] [ -2.4032649312e-15 -7.370012455680001e-15 -7.2097947936e-15 ] [ -2.08282960704e-15 -9.13240673856e-15 5.76783583488e-15 ] [ 4.96674752448e-15 -4.16565921408e-15 3.04413557952e-15 ] [ 7.370012455680001e-15 -3.2043532416e-16 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }