{ "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" [ 5.41274 0 0 ] "si-unit" "m" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00162551 5.52562 0 ] "si-unit" "m" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0447781 -0.0207227 5.37358 ] "si-unit" "m" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9523702 -1.1440658 4.061891 ] [ -0.6829003 -0.2817536 0.415242 ] [ -2.8620313 -3.3784331 -2.0692052 ] [ 2.5274741 2.1762097 -0.1470206 ] [ -0.4015078 -0.2806718 -0.0872425 ] [ -0.3176033 1.1845132 -3.8791613 ] [ 0.8652875 0.8480404 2.1136047 ] [ -0.0810892 0.876161 -0.4081081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.52586526878662e-09 -1.832995477416849e-09 6.507866796437934e-09 ] [ -1.094126894997306e-09 -4.514190307462349e-10 6.652910243742336e-10 ] [ -4.585479636857831e-09 -5.412846527756869e-09 -3.315232195077788e-09 ] [ 4.049459912697522e-09 3.486672303298182e-09 -2.355529680959885e-10 ] [ -6.432864102288423e-10 -4.496857960778535e-10 -1.39777893840144e-10 ] [ -5.088565819489286e-10 1.897799356068995e-09 -6.215101543172134e-09 ] [ 1.38634340277048e-09 1.35871050237388e-09 3.386368035952997e-09 ] [ -1.299192204393754e-10 1.403764670256749e-09 -6.538612565791085e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.503138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.688229766863607e-18 } }