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第五組
第五組
Abstract—The probability distribution of an electron in Futher, if we take the temperature effect into ac-
the washboard potential can be regraded as an electron count, [3] gives
moving in a periodic potential V (θ) = J cos θ driven by
a bias Iθ. The transition rate between two states obey ∆Eif s 2 −∆Eif /kb T
the Fermi’s Golden rule, so that we use the molecular
Γsq = γq e (3)
R
dynamics(MD) to verify the final probability distribu-
tion. We found that the distribution of same-energy- where R is related to the system evolving speed.
state transition(SEST) is a Boltzmann distribution and The Γif means the probability of the transition from
only related to the temperature. As the I increase, the |qi , si i transit to |qf , sf i under the Temperature T .
thermalization speed is faster. For exciting transition, as
J and T increase, the transition probability will decrease
and increase respectively. II. C OMPUTATION
Keywords—Washboard potential, Molecular Dynamics, For the first step, as we did in the previous work
Fermi’s Golden rule [2], we use the finite difference method to create the
hamiltonian operator and diagonalize it. Then we
have a set of wavefunction to calculate the transfer
I. I NTRODUCTION
rate. Next, in order to simplify the computation, we
In this paper, we consider how a wave-packet consider the local transition, namely, the SEST from
of an electron distribute in a washboard potential qi to qi+1 and qi−1 and the exciting transition from
which potential is V (θ) = J cos θ +Iθ. Hamiltonian s = 1(ground state) to s = 2 (first excited state).
of this model is Moreover, the exciting transition takes place when
∂2 only at q = 0.5 and q = −0.5 where the energy gap
H = H0 + H1 = 2 + J cos θ + Iθ (1) between two states is the smallest place in the bend.
∂θ
the first two terms belong to H0 , which represent an Then we have the master equation of the SEST,
electron in the periodic potential V (θ) = J cos θ, dPis
and the last term H1 tilt that periodic potential = Γsi,i+1 Pi+1
s
+ Γsi,i−1 Pi−1
s
− Γsi,i+1 Pis − Γsi,i−1 Pis
dt
providing the electron a driven force. Note that the (4)
equation(1) is already scaled by h̄2 /2M . To solve and the exciting transition,
this hamiltonian equation directly is quite difficult. dPq1
As a consequent, we shall first consider only H0 = Γ2,1 2 1,2 1
q Pq − Γq Pq (5)
part. We could get a set of wavefunction ψq,s (θ) = dt
|q, si = eiqθ uq,s (θ) forming a Hilbert space. The q is
dPq2
the Bloch wavenumber and s represent the energy = Γ1,2 1 2,1 2
q Pq − Γq Pq (6)
state. dt
Once we have the Hilbert space, we can apply To slove these master equations, we use the molec-
the Fermi’s Golden rule to discuss the transition rate ular dynamics combining 4th-oder Runge-Kutta in-
between two states, which gives tegral to compute the final probability distribution.
2π We give a gaussian distribution in the ground state
γqs = hqf , sf | H1 |qi , si i (2) as the initial condition.
h̄
2
IV. S UMMARY
The distribution of the both same-energy-state
transition and state-to-state transition are related to
the temperature and J. Former one is a Boltzmann
distribution. As J increase, the transition between
two states will decrease. The bias I change noth-
ing about the distribution but the evolving speed,
because of the transition rate. As T increase, the
Fig. 4: The total probability in the first excited state according to
transition between two state will also increase.
MD-time when J = 0.1 and kb T = 0.5. The subfigure(a) shows the
relation between J and transition rate under different I at kb T = 0.3. R EFERENCES
Jump and Fall represent transition from s = 1 to s = 2 and from
s = 2 to s = 1 respectively. The subfigure(b) is the distributions [1] Stephen Gasiorowicz, Quantum Physics, 3rd ed. Wiley, 2003.
under different I when J = 0.1, kb T = 0.5 [2] Ho Hsiao and Chih-Yun Cheng, Rotating Dipole In A Potential
Field
[3] Schön, G. and A. Zaikin (1990), Quantum coherent effects, phase
transitions, and the dissipative dynamics of ultra small tunnel
junctions, Physics Reports 198: 237-412.
(a) (b)