{ "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" [ [ -13.5084601 -14.0237749 -14.8413012 ] [ -3.7412157 -27.2608215 4.7074979 ] [ -11.5841663 31.615752 8.1227681 ] [ 16.775498 9.9283661 -28.9809314 ] [ 8.6576154 -20.7223279 17.8332643 ] [ 3.4007287 20.4628062 13.1587023 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.16429391335413e-08 -2.246856446525568e-08 -2.377838600079616e-08 ] [ -5.994088377293954e-09 -4.367665123094482e-08 7.542243139984068e-09 ] [ -1.855988057023023e-08 5.065401912073876e-08 1.301410925322057e-08 ] [ 2.687731091931373e-08 1.590699617921771e-08 -4.64325711206369e-08 ] [ 1.387102910003856e-08 -3.320082956346628e-08 2.857203936940636e-08 ] [ 5.448568061713195e-09 3.278502995971032e-08 2.108256535882205e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.667157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.869284633060954e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9976808 -0.0352054 0.1279808 ] [ 0.4992509 -0.2895706 2.4041212 ] [ 0.0274764 2.2848285 2.7223722 ] [ 2.2881115 1.5328841 0.0805235 ] [ 2.6729737 0.2777437 3.2671087 ] [ 2.6717508 2.0543607 2.3297172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.976808000000001e-11 -3.52054e-12 1.279808e-11 ] [ 4.992509e-11 -2.895706e-11 2.4041212e-10 ] [ 2.74764e-12 2.2848285e-10 2.7223722e-10 ] [ 2.2881115e-10 1.5328841e-10 8.05235e-12 ] [ 2.6729737e-10 2.777437e-11 3.2671087e-10 ] [ 2.6717508e-10 2.0543607e-10 2.3297172e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.3e-06 -2.04e-05 -1.7e-06 ] [ 5.7e-06 -1.3e-06 -8.9e-06 ] [ 1.19e-05 3.42e-05 -5.7e-06 ] [ 1.19e-05 -2.7e-06 3.28e-05 ] [ 2.98e-05 1.25e-05 -3.94e-05 ] [ -5.09e-05 -2.23e-05 2.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.32980660622e-14 -3.26844033336e-14 -2.7237002778e-15 ] [ 9.1324068138e-15 -2.0828296242e-15 -1.42593720426e-14 ] [ 1.90659019446e-14 5.479444088279999e-14 -9.1324068138e-15 ] [ 1.90659019446e-14 -4.3258769118e-15 5.255139359519999e-14 ] [ 4.77448636932e-14 2.0027207925e-14 -6.31257593796e-14 ] [ -8.155079067059998e-14 -3.572853893819999e-14 3.65296272552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.973195 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.398970316532563e-18 } }