{ "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" [ [ 1.372022186827797e-09 2.710237485650742e-09 3.600879137835033e-09 ] [ -2.050157380517998e-09 -1.462299392009366e-09 1.40499257841893e-09 ] [ 5.732118511472506e-10 -2.669193245414412e-09 5.939936840956474e-10 ] [ 2.000210645888193e-09 -1.334784558024826e-09 -8.290381213321939e-10 ] [ -2.442907907763779e-09 7.281988872133248e-10 4.085744246411117e-10 ] [ -6.391021657659609e-10 2.769128371266163e-09 -1.066352682622752e-09 ] [ 1.991632271825105e-09 1.073782936919374e-09 -1.921445560380058e-09 ] [ -8.049095016406079e-10 -1.815070645818663e-09 -2.191603620873381e-09 ] ] "source-value" [ [ 0.8563489000000002 1.6915972000000004 2.2474920000000003 ] [ -1.2796076000000003 -0.9126955000000002 0.8769274000000002 ] [ 0.35777070000000005 -1.6659794000000006 0.37074170000000006 ] [ 1.2484333000000003 -0.8331070000000003 -0.5174449000000001 ] [ -1.5247432000000005 0.45450600000000013 0.2550121000000001 ] [ -0.3988962000000001 1.7283540000000004 -0.6655650000000001 ] [ 1.2430791000000003 0.6702026000000001 -1.1992720000000001 ] [ -0.5023850000000001 -1.1328780000000003 -1.3678914000000002 ] ] } "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" -5.781374707978747e-18 "source-value" -36.084503 } }