{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8608899 -2.7179933 -4.7326826 ] [ 0.9944023 -6.8515877 4.5371705 ] [ -5.4074017 8.0898025 -0.8260138 ] [ -1.0758088 9.5117685 -3.4706846 ] [ 4.6279182 -8.03199 4.4922106 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.37929767086285e-09 -4.35470532075104e-09 -7.58259341538696e-09 ] [ 1.593208116729748e-09 -1.097745362830084e-08 7.269348499683447e-09 ] [ -8.663612583014175e-09 1.296129243238939e-08 -1.323419998818167e-09 ] [ -1.723635707810903e-09 1.523953311316189e-08 -5.560649724290599e-09 ] [ 7.414742343014818e-09 -1.286866659649939e-08 7.197314799029941e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2942324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.168664861796188e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7775552 2.220852 0.2169861 ] [ 1.1890014 2.0558201 4.2045137 ] [ 0.645578 3.6217628 2.1485011 ] [ 2.5012773 5.4679315 2.4988073 ] [ 2.9996446 2.8746396 2.4650369 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7775552e-10 2.220852e-10 2.169861e-11 ] [ 1.1890014e-10 2.0558201e-10 4.2045137e-10 ] [ 6.45578e-11 3.6217628e-10 2.1485011e-10 ] [ 2.5012773e-10 5.4679315e-10 2.4988073e-10 ] [ 2.9996446e-10 2.8746396e-10 2.4650369e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -6e-07 -1.3e-06 ] [ -5e-07 -1e-06 1.4e-06 ] [ -5.9e-06 1.8e-06 -1e-06 ] [ 5e-07 1.6e-06 0.0 ] [ 6.1e-06 -1.9e-06 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 -9.6130597248e-16 -2.08282960704e-15 ] [ -8.010883104e-16 -1.6021766208e-15 2.24304726912e-15 ] [ -9.45284206272e-15 2.88391791744e-15 -1.6021766208e-15 ] [ 8.010883104e-16 2.56348259328e-15 0.0 ] [ 9.77327738688e-15 -3.04413557952e-15 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725914354017e-18 } }