{ "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" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2809149 0.4437823 -4.1580251 ] [ -5.377804 -2.4952555 5.1237745 ] [ -0.5717804 -2.5608246 -1.0998498 ] [ 6.4007216 -10.833091 -0.6316305 ] [ -3.878753 6.3754549 -20.8099894 ] [ 3.1467008 9.0699338 21.5757202 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.500752889224466e-10 7.110176316427782e-10 -6.661890658805512e-09 ] [ -8.616191911031735e-09 -3.997840057959986e-09 8.209191781785032e-09 ] [ -9.160931966591734e-10 -4.102893337892396e-09 -1.762153650469573e-09 ] [ 1.025508658825909e-08 -1.735652527419569e-08 -1.011983628421737e-09 ] [ -6.214447425657402e-09 1.021460487190081e-08 -3.334127877046768e-08 ] [ 5.041570495949106e-09 1.453163600628683e-08 3.45681147661618e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.505956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.68323972210321e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3888765 1.4735119 0.9373918 ] [ 1.0455865 0.9812421 3.1683749 ] [ 2.5828965 1.0439071 0.0424023 ] [ 2.7196791 -0.1607211 2.0285501 ] [ 1.9697144 3.2765975 0.715571 ] [ 1.8034503 3.175218 3.0343415 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.888765e-11 1.4735119e-10 9.373918000000001e-11 ] [ 1.0455865e-10 9.812421e-11 3.1683749e-10 ] [ 2.5828965e-10 1.0439071e-10 4.24023e-12 ] [ 2.7196791e-10 -1.607211e-11 2.0285501e-10 ] [ 1.9697144e-10 3.2765975e-10 7.15571e-11 ] [ 1.8034503e-10 3.175218e-10 3.0343415e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.72e-05 0.0001857 6.22e-05 ] [ 4.33e-05 -1.55e-05 3.49e-05 ] [ 7.32e-05 -1.3e-05 8e-07 ] [ 4.5e-05 -0.000124 4.1e-06 ] [ -4.66e-05 -1.18e-05 -2.57e-05 ] [ -9.77e-05 -2.14e-05 -7.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.75574381048e-14 2.975242009338e-13 9.965538663479998e-14 ] [ 6.93742482522e-14 -2.4833737827e-14 5.59159645266e-14 ] [ 1.172793296088e-13 -2.082829624199999e-14 1.2817413072e-15 ] [ 7.209794852999999e-14 -1.98669902616e-13 6.568924199399999e-15 ] [ -7.466143114439999e-14 -1.89056842812e-14 -4.11759394938e-14 ] [ -1.565326571418e-13 -3.42865799676e-14 -1.222460771742e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.074191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.895804649865309e-18 } }