{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8040309 0.783518 -0.8473819 ] [ 1.38739 0.1270136 -0.0345242 ] [ 1.0476261 0.2112572 -2.1059741 ] [ 3.640768 -4.603758 -4.6530452 ] [ -1.3056541 -1.9425759 4.7981318 ] [ -1.6136406 2.686427 -1.1882086 ] [ 0.6475415 2.7381181 4.0310022 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.094729372780783e-09 1.255334221575975e-09 -1.357655469069084e-09 ] [ 2.222843821931712e-09 2.034982204436429e-10 -5.531386609182336e-11 ] [ 1.678482044759883e-09 3.384713468156698e-10 -3.374142467030322e-09 ] [ 5.833153371356775e-09 -7.376033435420967e-09 -7.45500023496566e-09 ] [ -2.091888473871665e-09 -3.112349691109519e-09 7.687454593477023e-09 ] [ -2.585337243693685e-09 4.304130532885882e-09 -1.903720039553499e-09 ] [ 1.037475852297763e-09 4.386948804809316e-09 6.458377483233365e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.833906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.857306725074484e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2924708 3.5915282 1.4830494 ] [ 0.5429521 2.0833783 1.5698435 ] [ 2.7131783 4.4151728 3.7928535 ] [ 4.3601889 2.4136602 2.2095387 ] [ 3.5693414 2.2255874 4.5379785 ] [ 4.3402749 4.9259878 1.9263054 ] [ 5.1981147 3.9703383 4.0267051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2924708e-10 3.5915282e-10 1.4830494e-10 ] [ 5.429521000000001e-11 2.0833783e-10 1.5698435e-10 ] [ 2.7131783e-10 4.4151728e-10 3.7928535e-10 ] [ 4.3601889e-10 2.4136602e-10 2.2095387e-10 ] [ 3.5693414e-10 2.2255874e-10 4.537978500000001e-10 ] [ 4.3402749e-10 4.9259878e-10 1.9263054e-10 ] [ 5.1981147e-10 3.9703383e-10 4.0267051e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.1e-05 5.74e-05 2.07e-05 ] [ -4.6e-06 -7.44e-05 2.85e-05 ] [ 0.0001235 -8.04e-05 -3.23e-05 ] [ -7.41e-05 0.000108 -1e-06 ] [ -6.1e-05 4.73e-05 -1.47e-05 ] [ -1.92e-05 -2.81e-05 -9.1e-06 ] [ -4.56e-05 -2.97e-05 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.297763062848e-13 9.196493803392e-14 3.316505605055999e-14 ] [ -7.370012455680001e-15 -1.1920194058752e-13 4.56620336928e-14 ] [ 1.978688126688e-13 -1.2881500031232e-13 -5.175030485184e-14 ] [ -1.1872128760128e-13 1.730350750464e-13 -1.6021766208e-15 ] [ -9.773277386880001e-14 7.578295416384e-14 -2.355199632576e-14 ] [ -3.076179111936e-14 -4.502116304448e-14 -1.457980724928e-14 ] [ -7.305925390848e-14 -4.758464563776e-14 1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.548807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.292281816073139e-18 } }