{ "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" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -30.9446135 -43.9797401 -62.3101648 ] [ -60.0435503 -55.0822967 19.0558999 ] [ -62.9536861 49.1855032 40.7996663 ] [ 52.2046271 11.7660815 -76.7839747 ] [ 63.6684907 -45.9363092 46.2908497 ] [ 38.0687321 84.0467613 32.9477236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.957873628939206e-08 -7.046331137708025e-08 -9.983188928075512e-08 ] [ -9.620037252048883e-08 -8.8251567992709e-08 3.053091730808506e-08 ] [ -1.008629240626019e-07 7.88038633093236e-08 6.536827148230164e-08 ] [ 8.36410330372021e-08 1.885134069772739e-08 -1.230214891164387e-07 ] [ 1.020081672811622e-07 -7.359808064607995e-08 7.416611714630671e-08 ] [ 6.09928325541185e-08 1.346577560088182e-07 5.278807246050041e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 94.713192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.517472619037416e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.9181687 -0.1592601 0.1032325 ] [ 0.3959791 -0.2662293 2.4313786 ] [ 0.1120782 2.1899033 2.7903063 ] [ 2.4452046 1.67974 0.0181328 ] [ 2.7263289 0.0416622 3.277958 ] [ 2.5594846 2.3392249 2.3108153 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.181687e-11 -1.592601e-11 1.032325e-11 ] [ 3.959791e-11 -2.662293e-11 2.4313786e-10 ] [ 1.120782e-11 2.1899033e-10 2.7903063e-10 ] [ 2.4452046e-10 1.67974e-10 1.81328e-12 ] [ 2.7263289e-10 4.166220000000001e-12 3.277958e-10 ] [ 2.5594846e-10 2.3392249e-10 2.3108153e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.41e-05 -2.56e-05 1.3e-06 ] [ 2.5e-05 1.3e-05 -1.07e-05 ] [ -2.82e-05 1.25e-05 -8.4e-06 ] [ 1.83e-05 -2.1e-06 2.27e-05 ] [ 1.47e-05 -3e-05 -1.26e-05 ] [ 4.4e-06 3.22e-05 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.463422276928e-14 -4.101572149248001e-14 2.08282960704e-15 ] [ 4.005441552e-14 2.08282960704e-14 -1.714328984256e-14 ] [ -4.518138070656001e-14 2.002720776e-14 -1.345828361472e-14 ] [ 2.931983216064e-14 -3.36457090368e-15 3.636940929216e-14 ] [ 2.355199632576e-14 -4.8065298624e-14 -2.018742542208e-14 ] [ 7.04957713152e-15 5.159008718975999e-14 1.249697764224e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }