{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4515476 6.7855779 4.7780676 ] [ 0.4318235 -1.1063249 -0.3771073 ] [ -1.8875506 1.4869365 -1.5844989 ] [ 4.7952309 -6.7948843 -4.3302169 ] [ -0.2192194 1.4153927 -2.9193774 ] [ 1.8248932 -1.7967134 2.1712588 ] [ -0.0729747 1.8368102 1.7188859 ] [ 0.5793446 -1.8267947 0.5429882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.734342183858775e-09 1.087169435956679e-08 7.655308264392457e-09 ] [ 6.91857521712099e-10 -1.772527904392386e-09 -6.041925045708281e-10 ] [ -3.02418946681268e-09 2.382334916541741e-09 -2.538647114178702e-09 ] [ 7.68280690261479e-09 -1.088660485619344e-08 -6.937772337331913e-09 ] [ -3.512282003994996e-10 2.267709111874171e-09 -4.677358256107671e-09 ] [ 2.923801244585488e-09 -2.878652227474695e-09 3.478740115726878e-09 ] [ -1.169183592131598e-10 2.942894383532866e-09 2.753958825492061e-09 ] [ 9.282123811540763e-10 -2.926847783455039e-09 8.699630065777188e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.241197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.486044575359089e-18 } }