{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3404548 0.095914 -0.9262767 ] [ -2.4424277 -2.0841567 1.260565 ] [ 0.1624626 -0.2420392 0.3221481 ] [ -0.0267861 -0.3279585 -5.583752 ] [ 0.7873333 -4.3205632 5.6531389 ] [ -1.4455804 4.816483 -2.7868648 ] [ 3.3054532 2.0623206 2.0610415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.454687209991398e-10 1.536711684074112e-10 -1.484058873131775e-09 ] [ -3.913200558934316e-09 -3.339187138823679e-09 2.019647771998752e-09 ] [ 2.602937794743821e-10 -3.877895475571354e-10 5.161381542551405e-10 ] [ -4.291606318241088e-11 -5.254474412926367e-10 -8.946156910745241e-09 ] [ 1.261447006037313e-09 -6.922305347728835e-09 9.05732697971503e-09 ] [ -2.316075120366713e-09 7.716856457080646e-09 -4.465049627890468e-09 ] [ 5.295919838188547e-09 3.304201849914228e-09 3.302152505798563e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.44237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.95479340461433e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1626936 1.3450196 1.4892075 ] [ 2.0222775 1.644663 3.8610888 ] [ 1.4501173 3.4538321 2.3726589 ] [ 4.3622872 2.1420106 1.6124036 ] [ 4.3415638 1.9952799 3.9634282 ] [ 3.6031436 4.3301595 2.0424939 ] [ 4.763425 4.2881523 4.0668201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1626936e-10 1.3450196e-10 1.4892075e-10 ] [ 2.0222775e-10 1.644663e-10 3.8610888e-10 ] [ 1.4501173e-10 3.4538321e-10 2.3726589e-10 ] [ 4.3622872e-10 2.1420106e-10 1.6124036e-10 ] [ 4.3415638e-10 1.9952799e-10 3.9634282e-10 ] [ 3.6031436e-10 4.3301595e-10 2.0424939e-10 ] [ 4.763425e-10 4.2881523e-10 4.0668201e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 -1.8e-05 -5.1e-05 ] [ 1.32e-05 2.45e-05 2.62e-05 ] [ -5.3e-06 -1.53e-05 2.48e-05 ] [ 1.5e-06 -1e-05 3e-07 ] [ -2.48e-05 2.2e-06 2.7e-06 ] [ -9e-07 1.93e-05 -1.65e-05 ] [ 1.23e-05 -2.6e-06 1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.4087064832e-15 -2.88391791744e-14 -8.17110076608e-14 ] [ 2.114873139456e-14 3.92533272096e-14 4.197702746496e-14 ] [ -8.491536090240001e-15 -2.451330229824e-14 3.973398019584e-14 ] [ 2.4032649312e-15 -1.6021766208e-14 4.8065298624e-16 ] [ -3.973398019584e-14 3.52478856576e-15 4.32587687616e-15 ] [ -1.44195895872e-15 3.092200878144e-14 -2.64359142432e-14 ] [ 1.970677243584e-14 -4.16565921408e-15 2.16293843808e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.589215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.619191215522467e-18 } }