{ "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" [ [ 0.1263174 0.4385011 2.440297 ] [ 1.443642 1.70162 0.7822092 ] [ 0.8295505 2.763862 2.693363 ] [ 2.917075 0.1010564 1.432133 ] [ 1.93191 1.054076 2.887848 ] [ 2.783401 2.698255 1.169851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.263174e-11 4.385011e-11 2.440297e-10 ] [ 1.443642e-10 1.70162e-10 7.822092e-11 ] [ 8.295505e-11 2.763862e-10 2.693363e-10 ] [ 2.917075e-10 1.010564e-11 1.432133e-10 ] [ 1.93191e-10 1.054076e-10 2.887848e-10 ] [ 2.783401e-10 2.698255e-10 1.169851e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.2858348 -4.6906167 -1.291487 ] [ -22.9494093 -13.8231479 -15.4220212 ] [ -5.1107861 8.8676823 2.5033298 ] [ 5.8614589 -6.0062773 -5.0301883 ] [ 9.4591108 -2.5255152 14.9144917 ] [ 23.0254606 18.1778749 4.3258751 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.647972404197105e-08 -7.515196413874047e-09 -2.06919027746713e-09 ] [ -3.676900704163009e-08 -2.214712439124062e-08 -2.470880181212196e-08 ] [ -8.188382003329612e-09 1.420759326174197e-08 4.01077647971194e-09 ] [ 9.391092413360084e-09 -9.623117068101749e-09 -8.059250092481697e-09 ] [ 1.515516617731678e-08 -4.046321408915037e-09 2.389564991285564e-08 ] [ 3.689085465647153e-08 2.912416618060714e-08 6.930815949720863e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3038387 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.895509744834265e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0603241 0.9703227 2.1879443 ] [ 1.1360393 0.9755506 0.227303 ] [ 1.279738 2.8514245 3.0106705 ] [ 3.1983429 0.5543215 1.4845492 ] [ 2.0019914 0.5490812 3.4451985 ] [ 2.4761084 2.85667 1.0500358 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.03241e-12 9.703227e-11 2.1879443e-10 ] [ 1.1360393e-10 9.755506e-11 2.27303e-11 ] [ 1.279738e-10 2.8514245e-10 3.0106705e-10 ] [ 3.1983429e-10 5.543215e-11 1.4845492e-10 ] [ 2.0019914e-10 5.490812000000001e-11 3.4451985e-10 ] [ 2.4761084e-10 2.85667e-10 1.0500358e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.1e-06 -2.23e-05 -7e-07 ] [ -8.5e-06 1.72e-05 -1.08e-05 ] [ 1.17e-05 1.4e-06 1.72e-05 ] [ -7e-06 7.1e-06 2.73e-05 ] [ -8.9e-06 -8.8e-06 5.9e-06 ] [ 6.6e-06 5.4e-06 -3.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.77327738688e-15 -3.572853864384e-14 -1.12152363456e-15 ] [ -1.36185012768e-14 2.755743787776e-14 -1.730350750464e-14 ] [ 1.874546646336e-14 2.24304726912e-15 2.755743787776e-14 ] [ -1.12152363456e-14 1.137545400768e-14 4.373942174784e-14 ] [ -1.425937192512e-14 -1.409915426304e-14 9.45284206272e-15 ] [ 1.057436569728e-14 8.65175375232e-15 -6.232467054911999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.293256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930902708150933e-18 } }