{ "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" [ [ 0.9949033 2.503274 2.364783 ] [ 2.081862 1.922853 4.128948 ] [ 3.003732 4.725891 2.729897 ] [ 1.175643 3.973335 4.072515 ] [ 3.741462 2.310355 2.499434 ] [ 3.610675 3.096222 4.683717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.949033000000001e-11 2.503274000000001e-10 2.364783e-10 ] [ 2.081862e-10 1.922853e-10 4.128948e-10 ] [ 3.003732e-10 4.725891e-10 2.729897e-10 ] [ 1.175643e-10 3.973335e-10 4.072515e-10 ] [ 3.741462e-10 2.310355e-10 2.499434e-10 ] [ 3.610675e-10 3.096222e-10 4.683717e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0634889 -2.6265255 -7.9641127 ] [ 1.1796058 -8.381823 9.3884904 ] [ 1.7247052 3.9976102 -1.4618185 ] [ -5.5656786 9.1968385 3.9052175 ] [ 5.5425843 -2.0273687 -8.8922771 ] [ 1.1822721 -0.1587315 5.0245005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.510426968098362e-09 -4.208157784705167e-09 -1.275991527848265e-08 ] [ 1.889936850090877e-09 -1.342916096092378e-08 1.504201994741331e-08 ] [ 2.763282371978297e-09 6.404877654280067e-09 -2.342091443848928e-09 ] [ -8.917200205273831e-09 1.473495975137161e-08 6.256848229187895e-09 ] [ 8.880199057435244e-09 -3.248202759642955e-09 -1.424699859267328e-08 ] [ 1.894208733650111e-09 -2.54315900379771e-10 8.050137298621317e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0700829 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.725344988822957e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4960232 2.4841423 2.0290804 ] [ 2.0360343 1.7657943 4.3847405 ] [ 2.951778 5.2891522 3.0866436 ] [ 1.0056648 3.976157 4.1000055 ] [ 4.1994855 1.6761755 2.4486976 ] [ 3.9192915 3.3405088 4.4301263 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.960232e-11 2.4841423e-10 2.0290804e-10 ] [ 2.0360343e-10 1.7657943e-10 4.3847405e-10 ] [ 2.951778e-10 5.289152200000001e-10 3.0866436e-10 ] [ 1.0056648e-10 3.976157e-10 4.1000055e-10 ] [ 4.1994855e-10 1.6761755e-10 2.4486976e-10 ] [ 3.9192915e-10 3.3405088e-10 4.4301263e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.49e-05 2.6e-06 -1e-05 ] [ 1.07e-05 9e-07 5.5e-06 ] [ 1.33e-05 -1.63e-05 1.77e-05 ] [ -6.3e-06 -2.4e-06 -1.08e-05 ] [ 1.33e-05 3.1e-06 1.04e-05 ] [ 3.9e-06 1.21e-05 -1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.59159645266e-14 4.165659248399999e-15 -1.602176634e-14 ] [ 1.71432899838e-14 1.4419589706e-15 8.811971486999999e-15 ] [ 2.13089492322e-14 -2.61154791342e-14 2.83585264218e-14 ] [ -1.00937127942e-14 -3.845223921599999e-15 -1.73035076472e-14 ] [ 2.13089492322e-14 4.9667475654e-15 1.66626369936e-14 ] [ 6.248488872599999e-15 1.93863372714e-14 -2.05078609152e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.097921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.258735961417791e-18 } }