{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.489786 0.6379758 2.385139 ] [ 2.264964 0.0865491 0.9234604 ] [ 2.944507 2.806058 0.1090737 ] [ 1.576252 2.005156 0.0788695 ] [ 2.792909 2.291732 2.895835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.89786e-11 6.379758e-11 2.385139e-10 ] [ 2.264964e-10 8.654910000000001e-12 9.234604e-11 ] [ 2.944507e-10 2.806058e-10 1.090737e-11 ] [ 1.576252e-10 2.005156e-10 7.88695e-12 ] [ 2.792909e-10 2.291732e-10 2.895835e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4567599 0.7933838 1.5436767 ] [ 2.6840298 -3.1816369 -0.521572 ] [ 33.3888807 19.2851407 1.9906105 ] [ -34.6462613 -17.1090521 -2.4482457 ] [ 0.0301108 0.2121646 -0.5644694 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.333986673128177e-09 1.271140986154129e-09 2.473242739190227e-09 ] [ 4.300289830519692e-09 -5.097544299052195e-09 -8.35650471348648e-10 ] [ 5.349488449295356e-08 3.08982018129424e-08 3.189309630495057e-09 ] [ -5.550943031031846e-08 -2.741172350450862e-08 -3.922522054830973e-09 ] [ 4.82428201910472e-11 3.399251646819564e-10 -9.043796832879996e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -0.33038813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.293401420369544e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.1616697 0.9490339 2.5821055 ] [ 1.8535342 -0.4590449 0.6574047 ] [ 2.8778362 3.0832664 0.6645065 ] [ 1.6867135 1.8059275 -0.3465307 ] [ 2.4886644 2.4482879 2.8348916 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1616697e-10 9.490339000000001e-11 2.5821055e-10 ] [ 1.8535342e-10 -4.590449e-11 6.574047e-11 ] [ 2.8778362e-10 3.0832664e-10 6.645065e-11 ] [ 1.6867135e-10 1.8059275e-10 -3.465307000000001e-11 ] [ 2.488664400000001e-10 2.4482879e-10 2.834891600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 4.36e-05 -2.54e-05 ] [ 1.48e-05 5.09e-05 4.22e-05 ] [ -3.46e-05 -2e-06 5.52e-05 ] [ -4.7e-06 -2.85e-05 -3.56e-05 ] [ 2.04e-05 -6.4e-05 -3.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.729141862799999e-15 6.985490124239999e-14 -4.06952865036e-14 ] [ 2.37122141832e-14 8.155079067059998e-14 6.761185395480001e-14 ] [ -5.54353115364e-14 -3.204353268e-15 8.844015019679999e-14 ] [ -7.530230179799999e-15 -4.5662034069e-14 -5.703748817039999e-14 ] [ 3.26844033336e-14 -1.02539304576e-13 -5.81590118142e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.295169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.809685584888114e-18 } }