{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8540722 -1.6451656 -5.4325596 ] [ -5.1836276 2.006214 5.7138226 ] [ -5.9196007 1.5827823 -1.7557938 ] [ 3.5140604 -0.8698088 -1.6500317 ] [ 5.8330447 -2.727728 4.5871808 ] [ -0.5998176 -3.3580319 -3.1856257 ] [ 5.2100129 5.011738 1.7230075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.572727752915222e-09 -2.635845861664404e-09 -8.7039199822226e-09 ] [ -8.305086951653614e-09 3.214309167121651e-09 9.15455298511867e-09 ] [ -9.484245846011314e-09 2.535896796876052e-09 -2.813091777305591e-09 ] [ 5.630145416959097e-09 -1.393587323926103e-09 -2.64364221331888e-09 ] [ 9.34556784642135e-09 -4.370302029501542e-09 7.34947383314264e-09 ] [ -9.61013735464366e-10 -5.380160202080603e-09 -5.103935019159635e-09 ] [ 8.347360862446408e-09 8.02968945317495e-09 2.760562333963056e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.238048 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.24249273562282e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2778132 1.6432792 2.552939 ] [ 2.0036893 3.2502632 4.5316681 ] [ 1.5089567 4.0754349 2.2952714 ] [ 4.7868156 1.9001132 2.0926628 ] [ 4.0295183 1.9058398 4.4064491 ] [ 3.2290239 3.2409973 0.7878861 ] [ 3.945388 4.1057773 3.0926385 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2778132e-10 1.6432792e-10 2.552939e-10 ] [ 2.0036893e-10 3.2502632e-10 4.5316681e-10 ] [ 1.5089567e-10 4.075434900000001e-10 2.2952714e-10 ] [ 4.7868156e-10 1.9001132e-10 2.0926628e-10 ] [ 4.0295183e-10 1.9058398e-10 4.4064491e-10 ] [ 3.2290239e-10 3.2409973e-10 7.878861e-11 ] [ 3.945388e-10 4.1057773e-10 3.0926385e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-05 3.32e-05 -6.7e-06 ] [ -9e-07 -6.3e-06 -1.76e-05 ] [ 1.22e-05 -2.05e-05 2.24e-05 ] [ -4.4e-06 -1.21e-05 1.44e-05 ] [ -4.4e-06 -9.3e-06 -5.4e-06 ] [ -1e-05 -1.08e-05 -3.6e-06 ] [ -2.6e-06 2.58e-05 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-14 5.319226381056e-14 -1.073458335936e-14 ] [ -1.44195895872e-15 -1.009371271104e-14 -2.819830852608e-14 ] [ 1.954655477376e-14 -3.28446207264e-14 3.588875630592e-14 ] [ -7.04957713152e-15 -1.938633711168e-14 2.307134333952e-14 ] [ -7.04957713152e-15 -1.490024257344e-14 -8.65175375232e-15 ] [ -1.6021766208e-14 -1.730350750464e-14 -5.76783583488e-15 ] [ -4.16565921408e-15 4.133615681664e-14 -5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }