{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.814525 -1.1068415 -1.0992076 ] [ -3.0809314 -0.6448337 3.009105 ] [ -3.6808246 -0.7382787 -1.3317998 ] [ 0.4520694 3.4199511 0.5392047 ] [ 1.3705166 -1.747132 -5.3163822 ] [ 3.8328288 -1.2491114 3.813977 ] [ 3.9208662 2.0662463 0.3851028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.50936615365712e-09 -1.773355574231203e-09 -1.761124718125678e-09 ] [ -4.936196259368614e-09 -1.033137478443961e-09 4.821117680532385e-09 ] [ -5.897331119385511e-09 -1.182852872774617e-09 -2.133778503146116e-09 ] [ 7.242950236590835e-10 5.479365696699244e-09 8.639011641654777e-10 ] [ 2.195809654938305e-09 -2.799214043851546e-09 -8.51778326807727e-09 ] [ 6.140868694888919e-09 -2.001297081854757e-09 6.110664781668922e-09 ] [ 6.281920158924937e-09 3.310491514674503e-09 6.170027027646183e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.487843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.122296644442094e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8897036 1.3647991 2.8985302 ] [ 1.9695004 2.3434325 5.0924356 ] [ 2.3225469 3.5943562 1.8841174 ] [ 2.9523141 4.3352084 4.1736227 ] [ 3.9651237 1.7127796 1.6053234 ] [ 4.1749882 1.9825275 4.0952348 ] [ 4.735876 3.8673387 2.530193 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8897036e-10 1.3647991e-10 2.8985302e-10 ] [ 1.9695004e-10 2.3434325e-10 5.0924356e-10 ] [ 2.3225469e-10 3.5943562e-10 1.8841174e-10 ] [ 2.9523141e-10 4.3352084e-10 4.1736227e-10 ] [ 3.9651237e-10 1.7127796e-10 1.6053234e-10 ] [ 4.1749882e-10 1.9825275e-10 4.0952348e-10 ] [ 4.735876000000001e-10 3.8673387e-10 2.530193e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 5.46e-05 -1.7e-06 ] [ 2.74e-05 -2.75e-05 3.39e-05 ] [ 4.79e-05 -2.76e-05 -2.34e-05 ] [ -2.05e-05 -1.03e-05 -4.1e-05 ] [ -1.93e-05 3.95e-05 4.72e-05 ] [ 4e-06 4.8e-06 -4.44e-05 ] [ -3.83e-05 -3.36e-05 2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 8.747884349568e-14 -2.72370025536e-15 ] [ 4.389963940992e-14 -4.4059857072e-14 5.431378744512e-14 ] [ 7.674426013632e-14 -4.422007473408001e-14 -3.749093292672001e-14 ] [ -3.28446207264e-14 -1.650241919424e-14 -6.56892414528e-14 ] [ -3.092200878144e-14 6.32859765216e-14 7.562273650176e-14 ] [ 6.4087064832e-15 7.69044777984e-15 -7.113664196352e-14 ] [ -6.136336457664001e-14 -5.383313445888e-14 4.710399265152e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.602861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.461159883659211e-18 } }