{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.735137 1.403924 2.79869 ] [ 2.045924 2.694064 4.682831 ] [ 2.274394 3.585822 2.431289 ] [ 3.715465 2.312241 1.138099 ] [ 3.875208 1.089856 3.316209 ] [ 4.61535 3.47459 2.663723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.735137e-10 1.403924e-10 2.79869e-10 ] [ 2.045924e-10 2.694064e-10 4.682831e-10 ] [ 2.274394e-10 3.585822e-10 2.431289e-10 ] [ 3.715465e-10 2.312241e-10 1.138099e-10 ] [ 3.875208e-10 1.089856e-10 3.316209e-10 ] [ 4.615350000000001e-10 3.47459e-10 2.663723e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.5865602 -2.8452362 -13.2679007 ] [ 2.384441 -0.7971276 7.9058276 ] [ -10.2314596 11.3877587 -3.0590806 ] [ -9.5556096 -10.1252301 -3.0907152 ] [ 0.3467075 -4.0758621 6.8802054 ] [ 11.4693606 6.4556973 4.6316635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.950656216874367e-09 -4.55857095785095e-09 -2.125752048377224e-08 ] [ 3.820295655351593e-09 -1.277139215036498e-09 1.26665322531523e-08 ] [ -1.639260550283499e-08 1.824520090277021e-08 -4.9011874588427e-09 ] [ -1.530977442474608e-08 -1.622240708009348e-08 -4.951871675788636e-09 ] [ 5.554866553325549e-10 -6.530251020026172e-09 1.102330432900062e-08 ] [ 1.837594156024022e-08 1.034316737023689e-08 7.420743036250658e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.30555 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.45221945805187e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6097965 1.3184133 2.5284391 ] [ 2.2346869 2.6126406 4.6618776 ] [ 2.2217155 3.7723178 2.4280872 ] [ 3.5388301 2.0627379 1.1057096 ] [ 3.9619955 1.2326471 3.4590137 ] [ 4.6944534 3.5617402 2.8477139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6097965e-10 1.3184133e-10 2.5284391e-10 ] [ 2.2346869e-10 2.6126406e-10 4.661877600000001e-10 ] [ 2.2217155e-10 3.7723178e-10 2.4280872e-10 ] [ 3.5388301e-10 2.0627379e-10 1.1057096e-10 ] [ 3.9619955e-10 1.2326471e-10 3.4590137e-10 ] [ 4.694453400000001e-10 3.5617402e-10 2.8477139e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001143 7.14e-05 6.55e-05 ] [ 0.0001126 9.1e-06 -4.92e-05 ] [ -8.55e-05 1.33e-05 -7.19e-05 ] [ -3e-07 -6.16e-05 7.3e-06 ] [ -9.05e-05 -4.68e-05 -8.29e-05 ] [ -5.07e-05 1.45e-05 0.0001311 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.831287892662e-13 1.143954116676e-13 1.04942569527e-13 ] [ 1.804050889884e-13 1.45798073694e-14 -7.882709039280001e-14 ] [ -1.36986102207e-13 2.13089492322e-14 -1.151964999846e-13 ] [ -4.806529901999999e-16 -9.86940806544e-14 1.16958894282e-14 ] [ -1.44996985377e-13 -7.498186647119999e-14 -1.328204429586e-13 ] [ -8.123035534379999e-14 2.3231561193e-14 2.100453567174e-13 ] ] } "relaxed-potential-energy" { "source-value" -22.071805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536293024120437e-18 } }