{ "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" [ [ -32.3367316 -22.3280556 -35.5894445 ] [ 40.9553793 12.2029212 22.088206 ] [ 74.3913477 -81.6217691 104.0911014 ] [ -366.9464067 264.5571813 -236.4535565 ] [ -46.1278201 -59.1077103 -29.3685796 ] [ 154.704488 -86.8575388 -109.6772162 ] [ 267.7503232 -112.4000107 370.0097928 ] [ -92.3905799 85.5549821 -85.1003033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.180915578944943e-08 -3.577348896497284e-08 -5.702057639493981e-08 ] [ 6.561775175106726e-08 1.955123521318324e-08 3.53892075401786e-08 ] [ 1.191880790567096e-07 -1.307724912777632e-07 1.667723304704047e-07 ] [ -5.879129587450011e-07 4.238673342357617e-07 -3.788403632504988e-07 ] [ -7.390491554157552e-08 -9.470099233190113e-08 -4.705365200888906e-08 ] [ 2.478639158485334e-07 -1.391611191521084e-07 -1.757222730778063e-07 ] [ 4.289833115769881e-07 -1.8008467080489e-07 5.928210443753413e-07 ] [ -1.480260283174901e-07 1.370741932429083e-07 -1.363457174935731e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 122.14208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.956931866041587e-17 } }