{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] "source-value" [ 5.40103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] "source-value" [ -0.134454 5.44836 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] "source-value" [ -0.122267 -0.177468 5.33534 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.034294069577796e-09 3.27957543394656e-09 4.023320561346831e-09 ] [ -2.656651086391465e-09 -1.905057536596543e-09 9.73548043821871e-10 ] [ 9.174007254519072e-10 -2.896044151412187e-09 7.575985077696807e-10 ] [ 1.867762389652885e-09 -1.567903018745509e-09 -9.933539909905381e-10 ] [ -2.485845119677584e-09 1.113628428608022e-09 4.641609811937952e-10 ] [ -7.710708905386637e-10 2.987816668033948e-09 -1.263642949313781e-09 ] [ 2.075726036556359e-09 1.012973444800545e-09 -1.773724235071649e-09 ] [ -9.816162848488955e-10 -2.024989268634837e-09 -2.187906918756209e-09 ] ] "source-value" [ [ 1.2697065000000003 2.0469500000000003 2.5111592000000003 ] [ -1.6581512000000005 -1.1890434000000003 0.6076409000000002 ] [ 0.5725965000000001 -1.8075686000000004 0.4728558000000001 ] [ 1.1657656000000003 -0.9786081000000002 -0.6200028000000001 ] [ -1.5515425000000005 0.6950722000000001 0.28970650000000003 ] [ -0.4812646000000001 1.8648485000000004 -0.7887039000000002 ] [ 1.2955663000000002 0.6322483000000001 -1.1070716000000003 ] [ -0.6126767000000001 -1.2638989000000003 -1.3655841000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.391306865266833e-18 "source-value" -33.649891 } }