{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9445553 -4.5795152 -2.013905 ] [ 4.0750364 0.0457091 -0.9025414 ] [ 1.3183164 -0.457203 2.6495522 ] [ -21.2508336 17.1608124 -9.9506765 ] [ -3.1572488 -3.2936362 -3.8823607 ] [ 8.5950573 -6.9777021 -3.3537251 ] [ 13.4306824 -5.9143017 20.9947503 ] [ -2.0664547 4.0158367 -3.5410937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.51334443118086e-09 -7.337192248487837e-09 -3.226631534095769e-09 ] [ 6.528928102779477e-09 7.323405198116939e-11 -1.446030742297647e-09 ] [ 2.112175732298997e-09 -7.325199635947019e-10 4.245050625403295e-09 ] [ -3.40475890469421e-08 2.749465264773746e-08 -1.59427413807929e-08 ] [ -5.058470255084538e-09 -5.27698696053655e-09 -6.220227598299883e-09 ] [ 1.377079997395113e-08 -1.117951126363273e-08 -5.373259992079313e-09 ] [ 2.151832551995504e-08 -9.475755990166478e-09 3.363729836732449e-08 ] [ -3.310825435559479e-09 6.434079726699668e-09 -5.673457584944606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.204728 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.038242626792555e-18 } }