{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.946306 16.3935383 21.7781924 ] [ -11.9998572 -45.91269 -26.6513045 ] [ 7.5580064 -9.9929002 8.8817284 ] [ 16.3881568 39.5120519 -4.0086162 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.914009217812276e-08 2.626534379644937e-08 3.489251070656424e-08 ] [ -1.922589065877855e-08 -7.356023851603794e-08 -4.270009698372183e-08 ] [ 1.210926115393677e-08 -1.601039107442764e-08 1.423009759477539e-08 ] [ 2.625672168296454e-08 6.330528579401623e-08 -6.422511157400137e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.4132698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.027519093644269e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7898059 1.7851711 2.9098205 ] [ 1.61997 1.2115601 -1.2915519 ] [ 2.0332183 0.607602 4.7550601 ] [ 1.6388609 2.075442 0.7336666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7898059e-10 1.7851711e-10 2.9098205e-10 ] [ 1.61997e-10 1.2115601e-10 -1.2915519e-10 ] [ 2.0332183e-10 6.07602e-11 4.7550601e-10 ] [ 1.6388609e-10 2.075442e-10 7.336666e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.043935 -0.1873948 0.3670788 ] [ -0.0076078 0.1531634 0.1600689 ] [ -0.0385765 0.2069774 -0.2447004 ] [ 0.0022493 -0.172746 -0.2824472 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.0391629834848e-11 -3.002395674194918e-10 5.881250713513189e-10 ] [ -1.218903929572224e-11 2.453948186422387e-10 2.564586492971731e-10 ] [ -6.18063664122912e-11 3.316143513139699e-10 -3.920532599804084e-10 ] [ 3.60377587316544e-12 -2.767696025367168e-10 -4.525303004504218e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3826842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.343054064478955e-18 } }