{ "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" [ [ 1.235296 0.1194615 1.060663 ] [ 0.5951279 1.958954 0.23753 ] [ 0.7849876 2.237774 2.150251 ] [ 2.634784 1.158802 0.6457174 ] [ 2.006718 1.111823 2.877883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.235296e-10 1.194615e-11 1.060663e-10 ] [ 5.951279e-11 1.958954e-10 2.3753e-11 ] [ 7.849876000000001e-11 2.237774e-10 2.150251e-10 ] [ 2.634784e-10 1.158802e-10 6.457174e-11 ] [ 2.006718e-10 1.111823e-10 2.877883e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.1889151 -31.3159542 -3.4845549 ] [ -14.3187922 11.0853776 -22.7061099 ] [ -19.4688431 25.4973842 16.0012584 ] [ 30.7953652 3.3958407 -15.6164383 ] [ 15.1811851 -8.6626483 25.8058447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.95287948061361e-08 -5.017368967728357e-08 -5.582872394674083e-09 ] [ -2.29412341009334e-08 1.776073282346001e-08 -3.637919843109543e-08 ] [ -3.11925252488434e-08 4.085131285679531e-08 2.563684211185962e-08 ] [ 4.933961415243792e-08 5.440736577501106e-09 -2.50202923444257e-08 ] [ 2.432293984325731e-08 -1.387909258047287e-08 4.13455210583356e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.116422 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.421917791854678e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6869939 -0.3902625 1.2246747 ] [ 0.6831987 1.7976817 0.0215412 ] [ 0.5563499 2.6550336 2.3632361 ] [ 3.1108002 1.6873294 0.5953223 ] [ 2.2195709 0.8370323 2.7672701 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.869939e-11 -3.902625e-11 1.2246747e-10 ] [ 6.831987e-11 1.7976817e-10 2.15412e-12 ] [ 5.563499e-11 2.6550336e-10 2.3632361e-10 ] [ 3.1108002e-10 1.6873294e-10 5.953223e-11 ] [ 2.2195709e-10 8.370323e-11 2.7672701e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.75e-05 2.39e-05 -6.6e-06 ] [ 1.46e-05 -0.0 4.4e-05 ] [ 5.1e-06 -1.95e-05 -1.12e-05 ] [ -2.23e-05 -2.83e-05 3.1e-06 ] [ -2.49e-05 2.4e-05 -2.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.4059857072e-14 3.829202123712e-14 -1.057436569728e-14 ] [ 2.339177866368e-14 0.0 7.04957713152e-14 ] [ 8.17110076608e-15 -3.12424441056e-14 -1.794437815296e-14 ] [ -3.572853864384e-14 -4.534159836864e-14 4.96674752448e-15 ] [ -3.989419785791999e-14 3.84522388992e-14 -4.694377498944e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }