{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] "source-value" [ 5.45189 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] "source-value" [ 0.103872 5.48254 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] "source-value" [ -0.0133572 0.0848103 5.46172 ] } "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" [ [ -4.915349057614088e-09 -6.284487967395093e-09 -6.956371628128595e-09 ] [ 5.63850701652539e-09 6.69763820846521e-09 2.524508365237743e-09 ] [ -9.410873046138144e-10 2.524144350709498e-10 -9.786799757559554e-10 ] [ 2.659015258213118e-09 2.667322864427289e-10 4.284493935786033e-09 ] [ -5.905030218919103e-10 -2.340937857385949e-09 -4.324960110697578e-09 ] [ -3.256470444898004e-10 1.104181995251785e-09 6.353698953278073e-10 ] [ -1.819689400581104e-09 1.169206012971629e-10 5.224097144196e-10 ] [ 2.947535544522106e-10 1.875384584708678e-10 4.293229803810945e-09 ] ] "source-value" [ [ -3.0679196 -3.9224689 -4.3418257 ] [ 3.5192793 4.180337 1.5756742 ] [ -0.5873805 0.1575447 -0.610844 ] [ 1.6596268 0.1664812 2.6741708 ] [ -0.368563 -1.4610985 -2.6994278 ] [ -0.2032529 0.6891762 0.3965667 ] [ -1.1357608 0.0729761 0.3260625 ] [ 0.1839707 0.1170523 2.6796233 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.689877445300437e-18 "source-value" -35.513422 } }