{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9934568 -2.767286 -0.1584316 ] [ -3.0401969 3.4000939 -1.4001276 ] [ 1.7914102 -1.730531 -5.0077261 ] [ 1.9846854 -1.9763571 4.2379604 ] [ 3.2575581 3.0740802 2.3283249 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.398223121134782e-09 -4.433680932267149e-09 -2.538354055159373e-10 ] [ -4.870932395808636e-09 5.447550955104693e-09 -2.243251706856814e-09 ] [ 2.870155540702653e-09 -2.772616309769645e-09 -8.023261680789964e-09 ] [ 3.179816547523096e-09 -3.166473139972088e-09 6.789961072756217e-09 ] [ 5.219183428717669e-09 4.925219426904188e-09 3.730387720406498e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5039736 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.042051444422041e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5734035 2.2413902 2.447739 ] [ 2.3550431 4.8209773 2.5398584 ] [ 4.6663125 2.6195668 0.9688231 ] [ 4.1584344 2.450999 4.4859084 ] [ 4.8797895 4.3529616 2.8819921 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5734035e-10 2.2413902e-10 2.447739e-10 ] [ 2.3550431e-10 4.8209773e-10 2.5398584e-10 ] [ 4.666312500000001e-10 2.6195668e-10 9.688231000000001e-11 ] [ 4.1584344e-10 2.450999e-10 4.4859084e-10 ] [ 4.879789500000001e-10 4.3529616e-10 2.8819921e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.68e-05 2.28e-05 5.9e-06 ] [ 4.8e-06 -2.2e-06 -2.66e-05 ] [ -3.2e-05 2e-07 1.55e-05 ] [ 1.5e-06 -3.35e-05 6e-06 ] [ -1.11e-05 1.27e-05 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.896009964544001e-14 3.652962695424e-14 9.45284206272e-15 ] [ 7.69044777984e-15 -3.52478856576e-15 -4.261789811328e-14 ] [ -5.12696518656e-14 3.2043532416e-16 2.48337376224e-14 ] [ 2.4032649312e-15 -5.36729167968e-14 9.6130597248e-15 ] [ -1.778416049088e-14 2.034764308416e-14 -1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658081798169e-18 } }