{ "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" [ [ 2.264039 2.962814 1.145416 ] [ 2.607686 1.947625 3.138097 ] [ 3.569117 1.227918 0.4731936 ] [ 5.155867 2.512325 3.932817 ] [ 4.543954 3.206398 1.939601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.264039e-10 2.962814e-10 1.145416e-10 ] [ 2.607686e-10 1.947625e-10 3.138097e-10 ] [ 3.569117e-10 1.227918e-10 4.731936e-11 ] [ 5.155867e-10 2.512325e-10 3.932817e-10 ] [ 4.543954e-10 3.206398e-10 1.939601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1399684 0.5030736 -0.1825134 ] [ 1.3724573 0.0245085 0.6007419 ] [ 0.3729432 0.193043 0.3692434 ] [ -0.9627412 -0.6219193 0.6491801 ] [ -0.6426908 -0.0987058 -1.4366519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.242540999783655e-10 8.060127671022624e-10 -2.924187048718956e-10 ] [ 2.198919017222728e-09 3.9266946034389e-11 9.624946352447645e-10 ] [ 5.975208808491887e-10 3.09288983957262e-10 5.915931477387156e-10 ] [ -1.542481455229121e-09 -9.96424570693636e-10 1.040101187477784e-09 ] [ -1.029704182646767e-09 -1.581441264002772e-10 -2.301770105371704e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.094787 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937798512460696e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6569079 3.2710244 1.8615161 ] [ 2.7570122 1.1959392 3.0497313 ] [ 3.4853992 1.3112661 0.7657115 ] [ 4.2564748 2.9817657 3.618092 ] [ 4.9848689 3.0970847 1.3340738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6569079e-10 3.2710244e-10 1.8615161e-10 ] [ 2.7570122e-10 1.1959392e-10 3.0497313e-10 ] [ 3.4853992e-10 1.3112661e-10 7.657115e-11 ] [ 4.256474800000001e-10 2.9817657e-10 3.618092e-10 ] [ 4.984868900000001e-10 3.0970847e-10 1.3340738e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 4.9e-06 1.8e-06 ] [ -8.6e-06 -2.4e-06 7.1e-06 ] [ 1.8e-06 -1.08e-05 -6.8e-06 ] [ 2.3e-06 -2.7e-06 4e-06 ] [ 9e-06 1.09e-05 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012516399999e-15 7.850665506599998e-15 2.8839179412e-15 ] [ -1.37787190524e-14 -3.845223921599999e-15 1.13754541014e-14 ] [ 2.8839179412e-15 -1.73035076472e-14 -1.08948011112e-14 ] [ 3.685006258199999e-15 -4.3258769118e-15 6.408706535999999e-15 ] [ 1.4419589706e-14 1.74637253106e-14 -9.773277467399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }