{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -40.5253007 -7.4860684 -4.1664875 ] [ 0.1101966 -0.2750079 -0.4475721 ] [ -15.661934 10.2259585 -6.6634958 ] [ -0.2126977 -6.7960672 13.657528 ] [ 43.5472327 0.9354259 6.2026055 ] [ 12.7425031 3.3957591 -8.5825781 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.492868933242988e-08 -1.199400377218966e-08 -6.675448863355439e-09 ] [ 1.765544162116493e-10 -4.406112279153044e-10 -7.170895547423596e-10 ] [ -2.509318449131263e-08 1.638379163397104e-08 -1.067609718355899e-08 ] [ -3.407792822379321e-10 -1.088849998122572e-08 2.188177205952138e-08 ] [ 6.977035813247727e-08 1.498717507470799e-09 9.937669520145494e-09 ] [ 2.041574055729153e-08 5.440605839888849e-09 -1.375080597801008e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.9446093 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.319960798650254e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7240523 0.332615 0.3400006 ] [ 0.3791343 0.1237139 2.7184306 ] [ 0.7841511 2.8025135 0.8461502 ] [ 0.426772 2.0754462 3.1184051 ] [ 3.1796905 0.2965202 0.1704186 ] [ 3.2402867 2.7877769 0.6807172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.240523e-11 3.32615e-11 3.400006e-11 ] [ 3.791343e-11 1.237139e-11 2.7184306e-10 ] [ 7.841511000000001e-11 2.8025135e-10 8.461502e-11 ] [ 4.26772e-11 2.0754462e-10 3.1184051e-10 ] [ 3.1796905e-10 2.965202000000001e-11 1.704186e-11 ] [ 3.2402867e-10 2.7877769e-10 6.807172e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.53e-05 4.18e-05 -1.46e-05 ] [ 8.39e-05 -0.0002109 -1.37e-05 ] [ -1.6e-06 5e-07 -0.0001323 ] [ -2.41e-05 0.0002136 9.86e-05 ] [ 1.6e-06 -8.53e-05 -4.83e-05 ] [ -1.44e-05 4.02e-05 0.0001103 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.257860092224001e-14 6.697098274944e-14 -2.339177866368e-14 ] [ 1.3442261848512e-13 -3.3789904932672e-13 -2.194981970496e-14 ] [ -2.56348259328e-15 8.010883104e-16 -2.1196796693184e-13 ] [ -3.861245656128e-14 3.4222492620288e-13 1.5797461481088e-13 ] [ 2.56348259328e-15 -1.3666566575424e-13 -7.738513078464e-14 ] [ -2.307134333952e-14 6.440750015616e-14 1.7672008127424e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.873415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.382983778445603e-18 } }