{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.8687559 -9.0922136 6.3725394 ] [ -7.9570501 7.7563116 1.1843414 ] [ 8.3050671 -9.820272 -8.659831 ] [ 9.8663147 11.5147623 0.1331025 ] [ -0.3455757 -0.3585883 0.9698477 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.581149010962964e-08 -1.456733218125702e-08 1.020993372592438e-08 ] [ -1.274859974578736e-08 1.242698121154315e-08 1.897524117758848e-09 ] [ 1.330618445142214e-08 -1.573381033792445e-08 -1.387457888258885e-08 ] [ 1.580757887603072e-08 1.844868310312409e-08 2.13253715426985e-10 ] [ -5.536733118181937e-10 -5.745217954857822e-10 1.553867323478642e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6997446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.554070415388768e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1165507 0.2075602 1.7057876 ] [ 0.1394257 2.5497614 0.9644951 ] [ 1.8233028 0.7630574 0.2812538 ] [ 2.5621065 3.0295672 0.9277876 ] [ 1.7055817 1.5428921 2.7046042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.165507e-11 2.075602e-11 1.7057876e-10 ] [ 1.394257e-11 2.5497614e-10 9.644951000000001e-11 ] [ 1.8233028e-10 7.630574e-11 2.812538e-11 ] [ 2.5621065e-10 3.0295672e-10 9.277876000000001e-11 ] [ 1.7055817e-10 1.5428921e-10 2.7046042e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.13e-05 6.04e-05 -1.25e-05 ] [ 3.17e-05 -2.49e-05 3.02e-05 ] [ 2.04e-05 -2.03e-05 1.07e-05 ] [ -5.78e-05 -1.35e-05 1.16e-05 ] [ -5.6e-06 -1.8e-06 -3.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.81045959642e-14 9.677146869359998e-14 -2.0027207925e-14 ] [ 5.078899929779999e-14 -3.989419818659999e-14 4.838573434679999e-14 ] [ 3.26844033336e-14 -3.252418567019999e-14 1.71432899838e-14 ] [ -9.26058094452e-14 -2.162938455899999e-14 1.85852489544e-14 ] [ -8.972189150399999e-15 -2.8839179412e-15 -6.392684769659999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }