{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8390273 1.0390287 0.341886 ] [ -3.9849058 -1.0885208 4.6880769 ] [ 5.1523894 -0.9897711 -2.6909508 ] [ 1.2766614 1.2060575 -1.3351291 ] [ -1.6051177 -0.1667943 -1.003883 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.344269924272948e-09 1.664707491480217e-09 5.477617561788288e-10 ] [ -6.38452290885032e-09 -1.744002577014513e-09 7.51112720569254e-09 ] [ 8.25503783793774e-09 -1.585788116363499e-09 -4.311378459483056e-09 ] [ 2.045437047757797e-09 1.932317129840496e-09 -2.139112629769746e-09 ] [ -2.571682052572268e-09 -2.672339279427015e-10 -1.608397872618567e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.220761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.957981756258443e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9832223 1.902344 0.173032 ] [ 1.0595689 1.5299628 2.5922908 ] [ 3.0973982 1.1819569 1.2349193 ] [ 2.1499786 3.5283559 1.6259811 ] [ 4.4887981 3.0989734 1.4860846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.832223e-11 1.902344e-10 1.73032e-11 ] [ 1.0595689e-10 1.5299628e-10 2.5922908e-10 ] [ 3.0973982e-10 1.1819569e-10 1.2349193e-10 ] [ 2.1499786e-10 3.5283559e-10 1.6259811e-10 ] [ 4.4887981e-10 3.0989734e-10 1.4860846e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.2e-06 -7.8e-06 -3.1e-06 ] [ 2.09e-05 1.83e-05 -2.16e-05 ] [ -7.2e-06 1.78e-05 1.11e-05 ] [ -1.85e-05 -1.67e-05 1.72e-05 ] [ 9.9e-06 -1.15e-05 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.33131842816e-15 -1.249697764224e-14 -4.96674752448e-15 ] [ 3.348549137472e-14 2.931983216064e-14 -3.460701500928e-14 ] [ -1.153567166976e-14 2.851874385024e-14 1.778416049088e-14 ] [ -2.96402674848e-14 -2.675634956736e-14 2.755743787776e-14 ] [ 1.586154854592e-14 -1.84250311392e-14 -5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.106817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.260161239130399e-18 } }