{ "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" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9679525 -3.7749571 2.5403965 ] [ 2.8231405 -2.4167626 -4.1372252 ] [ 3.3536579 -13.0759464 5.6044541 ] [ 5.5157901 9.5189268 0.9241592 ] [ -3.9977839 1.1390778 -11.8770811 ] [ 2.6658065 0.3075701 6.2353923 ] [ -2.3926585 8.3020913 0.7099041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.276606731632188e-08 -6.048148059972401e-09 4.070163913395381e-09 ] [ 4.523169743599077e-09 -3.872080567645088e-09 -6.628565545035976e-09 ] [ 5.373152325809508e-09 -2.094997578951641e-08 8.979325405345498e-09 ] [ 8.837270016268523e-09 1.525100209971639e-08 1.480666276336133e-09 ] [ -6.405155952361392e-09 1.825003835468125e-09 -1.902918181854302e-08 ] [ 4.271092885065321e-09 4.927816275370434e-10 9.990199846883516e-09 ] [ -3.833461541841489e-09 1.330141669419468e-08 1.137391761400799e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.718187 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.518331194024256e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5136861 2.3121242 3.1446875 ] [ 5.5235738 2.2188821 1.5287275 ] [ 4.6685011 1.2144731 3.4751889 ] [ 5.368205 4.5960688 1.8597296 ] [ 3.3985528 3.3515059 1.1302664 ] [ 4.0151244 3.0064924 4.9402758 ] [ 3.4092658 4.6489086 3.2741073 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5136861e-10 2.3121242e-10 3.1446875e-10 ] [ 5.523573800000001e-10 2.2188821e-10 1.5287275e-10 ] [ 4.668501100000001e-10 1.2144731e-10 3.4751889e-10 ] [ 5.368205e-10 4.5960688e-10 1.8597296e-10 ] [ 3.3985528e-10 3.3515059e-10 1.1302664e-10 ] [ 4.015124400000001e-10 3.0064924e-10 4.940275800000001e-10 ] [ 3.4092658e-10 4.6489086e-10 3.2741073e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.1e-06 -4.62e-05 1.28e-05 ] [ -2.78e-05 -2.19e-05 -3.21e-05 ] [ 5.49e-05 -1.66e-05 3.2e-05 ] [ 1.07e-05 -7.9e-06 9.6e-06 ] [ -2.3e-06 2.98e-05 -6.2e-05 ] [ -3.8e-05 7.1e-06 1.09e-05 ] [ 1.06e-05 5.57e-05 2.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.29776307354e-14 -7.40205604908e-14 2.05078609152e-14 ] [ -4.454051042519999e-14 -3.50876682846e-14 -5.14298699514e-14 ] [ 8.795949720659999e-14 -2.65961321244e-14 5.126965228799999e-14 ] [ 1.71432899838e-14 -1.26571954086e-14 1.53808956864e-14 ] [ -3.685006258199999e-15 4.77448636932e-14 -9.933495130799999e-14 ] [ -6.088271209199999e-14 1.13754541014e-14 1.74637253106e-14 ] [ 1.69830723204e-14 8.924123851379999e-14 4.598246939579999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.475251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.600932199548513e-18 } }