diff --git a/input/negf/StewartFrancois2006/GAA_VdsVary b/input/negf/StewartFrancois2006/GAA_VdsVary index 4afc052..88a0e8b 100644 --- a/input/negf/StewartFrancois2006/GAA_VdsVary +++ b/input/negf/StewartFrancois2006/GAA_VdsVary @@ -10,10 +10,10 @@ amrex.the_arena_is_managed=1 ############################ my_constants.gx = 2 -my_constants.gy = 16 +my_constants.gy = 16*2 my_constants.gz = 2 -my_constants.Channel_unitcells = 56 +my_constants.Channel_unitcells = 184 my_constants.Overlap_unitcells = 36 my_constants.Gap_unitcells = 0 my_constants.N_unitcells = Channel_unitcells + 2*Overlap_unitcells + 2*Gap_unitcells #64 @@ -25,8 +25,8 @@ cnt.Fermi_tail_factors = 14 14 my_constants.Vgs = 0.8 #Drain-Source voltage [V] my_constants.Vds_min = -0.3 -my_constants.Vds_max = 0. -my_constants.Nsteps = 16 +my_constants.Vds_max = -0.02 +my_constants.Nsteps = 15 my_constants.dt = 1./(Nsteps-1) cnt.eq_integration_pts = 50 50 50 @@ -34,12 +34,13 @@ cnt.flag_compute_flatband_dos = 0 cnt.flatband_dos_integration_pts = 400 cnt.flatband_dos_integration_limits = -1. 1. -cnt.num_noneq_paths = 3 -cnt.noneq_percent_intercuts = 20 50 -cnt.noneq_integration_pts = 500 20000 800 -cnt.noneq_integration_pts_density = 500 1600 50 -cnt.flag_adaptive_integration_limits = 1 -cnt.integrand_correction_interval = 50 +cnt.num_noneq_paths = 1 +#cnt.noneq_percent_intercuts = 20 50 +#cnt.noneq_integration_pts = 500 20000 800 +#cnt.noneq_integration_pts_density = 500 1600 50 +cnt.flag_adaptive_integration_limits = 0 +cnt.noneq_integration_pts = 400 +#cnt.integrand_correction_interval = 50 cnt.flag_write_integrand = 0 #cnt.write_integrand_interval = 1 cnt.kT_window_around_singularity = 3 2