{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.334116 -0.0436343 0.7600394 ] [ 0.0006908 1.3958784 0.0244153 ] [ -0.109877 -3.6297925 -0.0818326 ] [ -0.5465642 -0.0769078 0.5424182 ] [ -0.6783656 2.3544562 -1.2450403 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.137489482245544e-09 -6.990985590094618e-11 1.21771736759938e-09 ] [ 1.1067836187672e-12 2.236443756385305e-09 3.911762317210019e-11 ] [ -1.76042362014018e-10 -5.815568729768445e-09 -1.311102796194684e-10 ] [ -8.756923902209027e-10 -1.232198801323452e-10 8.690497658963387e-10 ] [ -1.08686151362939e-09 3.77225470941643e-09 -1.99477447704835e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.976626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.079084696535688e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.369235 2.8005916 0.7371723 ] [ 1.4118993 1.3568939 2.6863524 ] [ 2.5695294 4.5072398 1.9749331 ] [ 2.6121524 3.0635558 3.9241279 ] [ 3.549228 2.235097 1.7803296 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.369235e-10 2.8005916e-10 7.371723000000001e-11 ] [ 1.4118993e-10 1.3568939e-10 2.6863524e-10 ] [ 2.5695294e-10 4.5072398e-10 1.9749331e-10 ] [ 2.6121524e-10 3.0635558e-10 3.9241279e-10 ] [ 3.549228e-10 2.235097e-10 1.7803296e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.99e-05 1.05e-05 -1.02e-05 ] [ -2.56e-05 3e-07 1.5e-05 ] [ -2.24e-05 -3.34e-05 4.1e-06 ] [ 2.3e-05 1.6e-06 -4.8e-06 ] [ -5e-06 2.09e-05 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.790508135659999e-14 1.6822854657e-14 -1.63422016668e-14 ] [ -4.10157218304e-14 4.806529901999999e-16 2.403264951e-14 ] [ -3.588875660159999e-14 -5.351269957559999e-14 6.568924199399999e-15 ] [ 3.6850062582e-14 2.5634826144e-15 -7.690447843199998e-15 ] [ -8.010883169999999e-15 3.34854916506e-14 -6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888462318406e-18 } }