Hi Daehan,

This happens because the tight binding models have a finite band width.
Compare your results with a band structure of the model you are considering.

Best,
Anton

On Thu, 12 Mar 2020 at 09:00, dae han Park <[email protected]> wrote:

> Hello.
>
> My name is Daehan Park. I am a new user for Kwant.
>
> To accustom me to using Kwant, I start to attack simple quantum mechanics
> problems in kwant program.
>
> In below code, I try to solve a simple square barrier problem.
> ==================================================================
> import kwant
> import math
> from matplotlib import pyplot
> syst = kwant.Builder()
>
> wire = kwant.lattice.chain(1)
> t = 1.0       # hopping parameter
> W = 100    # the number of atoms in the direction of width
>
> for i in range(W):
>     # on-site Hamiltonian
>     syst[(wire(i))]=2*t
>
> for i in range(10):
>     # on-site Hamiltonian
>     syst[(wire(i+10))]=2*t + 0.5
>
> syst[wire.neighbors()] = -t     # hopping
>
> # attaching leads
> sys_left_lead = kwant.TranslationalSymmetry([-1])
> left_lead = kwant.Builder(sys_left_lead)
> left_lead[wire(0)] =  2*t
> left_lead[wire.neighbors()] = -t
> syst.attach_lead(left_lead)
> syst.attach_lead(left_lead.reversed())
>
> kwant.plot(syst)
> sys = syst.finalized()
>
> def plot_conductance(sys, energies):
>     # Compute conductance
>     data = []
>     for energy in energies:
>         smatrix = kwant.smatrix(sys, energy)
>         data.append(smatrix.transmission(1, 0))
>
>     pyplot.figure()
>     pyplot.plot(energies, data)
>     pyplot.xlabel("energy [t]")
>     pyplot.ylabel("conductance [e^2/h]")
>     pyplot.show()
>
> plot_conductance(sys, energies=[0.01* i + 1e-6 for i in range(500)])
> ========================================================================
>
> The outcome above the code is as following;
>
> [image: image.png]
>
> My question is why conductance becomes zero when the incident energy is
> over 4.
>
> Thank you for reading my e-mail
>
> Sincerely,
> Daehan Park.
>
> =====================================
> Department of Physics,
> Soongsil University,
> 369, Sangdo-ro, Dongjak-gu,
> Seoul 156-743,
> Republic of Korea (South Korea)
> mail:  [email protected]
> =====================================
> ᐧ
>

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