Canonical Transformation of the Hubbard Model

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Discussion Overview

The discussion revolves around the canonical transformation of the Hubbard model, specifically focusing on the strong coupling limit and the implications of choosing a specific operator in the transformation. Participants explore the mathematical formulation and implications of the transformation on the Hamiltonian, including the treatment of terms at different orders of t.

Discussion Character

  • Technical explanation
  • Mathematical reasoning
  • Debate/contested

Main Points Raised

  • One participant questions the elimination of first-order terms in the transformed Hamiltonian, suggesting that a t-dependent term remains even after the choice of operator.
  • Another participant proposes that the operator can be chosen to commute with the hopping Hamiltonian, potentially simplifying the expression.
  • Several participants reiterate the expression for the Hamiltonian up to first order in t, discussing the implications of choosing the operator such that certain terms vanish.
  • Concerns are raised about the presence of second-order terms in the transformed Hamiltonian, with a participant suggesting that the book's notation may be misleading regarding the order of terms.
  • Another participant clarifies that the choice of operator leads to a Hamiltonian that includes perturbations around the Hubbard U term, indicating a connection to the Heisenberg model and superexchange interactions.

Areas of Agreement / Disagreement

Participants express differing views on the treatment of terms in the Hamiltonian after the canonical transformation. There is no consensus on whether the first-order term can be entirely eliminated or if second-order terms should be considered differently.

Contextual Notes

Participants discuss the implications of operator choices and the resulting mathematical expressions, highlighting the dependence on specific definitions and assumptions regarding the Hamiltonian terms.

maverick280857
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Hi,

Suppose we have a 2 site Hubbard model, with the hopping Hamiltonian given by H_t and the Coulomb interaction Hamiltonian given by \hat{H}_U. In the strong coupling limit (U/t >> 1), we define a canonical transformation of \hat{H} = \hat{H}_U + \hat{H}_t, as

H' = e^{-t\hat{O}}\hat{H}e^{t\hat{O}} = \hat{H} - t[\hat{O},\hat{H}] + \frac{t^2}{2}[\hat{O},[\hat{O},\hat{H}]] + \ldots

Atland and Simons say (on page 63):

By choosing the operator \hat{O} such that \hat{H}_t - t[\hat{O}, \hat{H}_U] = 0, all terms at first order in t can be eliminated from the transformed Hamiltonian. As a result, the effective Hamiltonian is brought to the form

\hat{H}' = \hat{H}_U + \frac{t}{2}[\hat{H}_t, \hat{O}] + O(t^3)

I don't get this. Even if this choice is made,

\hat{H} - t[\hat{O}, \hat{H}] = (\hat{H}_U - t[\hat{O},\hat{H}_t]) + \underbrace{(\hat{H}_t - t[\hat{O},\hat{H}_U])}_{\mbox{0 by choice}} = \hat{H}_U - t[\hat{O},\hat{H}_t]

So there's still a t-dependent first order term. What's wrong here?
 
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I would guess that O can be chosen so that it commutes with H_t.
 
upto first order in t:

H_U + H_t - t[O,H_U] - t[O,H_t] ... (Eq 1)

Now choosing H_t - t[O,H_U] =0 \Rightarrow H_t = t[O,H_U]
Put this back to Eq. 1, and you'll have no order t term left.
 
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vkroom said:
upto first order in t:

H_U + H_t - t[O,H_U] - t[O,H_t] ... (Eq 1)

Now choosing H_t - t[O,H_U] =0 \Rightarrow H_t = t[O,H_U]
Put this back to Eq. 1, and you'll have no order t term left.

How is H_U - t[O, H_t] = 0?

In fact

H_U - t[O, H_t] = H_U - t[O, t[O, H_U]] = H_U - t^2[O, O H_U - H_U O]

Are you using some projection property of the O, like O H_U O = 0 here?
 
Don t forget that H_t is already first order in t, so t times it s commutator with O is second order.
 
Yes, that's what my last post says DrDu. But the t^2 term isn't zero -- or at least I don't see it.

Shouldn't the expression in the book then say O(t^2) instead of O(t^3)?
 
As I understood your first post, the transformed hamiltonian in the book is explicitly written down including all second order terms and the third order terms are abbreviated O(t^3). So yes, there is a second order order term in the transformed hamiltonian but not a first order term any more as you originally claimed.
 
maverick280857 said:
How is H_U - t[O, H_t] = 0?

You don't want it to vanish. All I meant is, by that particular choice of operator \hat{O} your Hamiltonian becomes H = H_U + \mathcal{O}(t^2), which is what you deduce below.

maverick280857 said:
In fact

H_U - t[O, H_t] = H_U - t[O, t[O, H_U]] = H_U - t^2[O, O H_U - H_U O]

When written in this way one can see that the \mathcal{O}(t^2) are perturbations about the Hubbard U term, i.e. your original system is a one with all electrons frozen at their lattice sites and then your introduce hopping by the t terms. In fact the \mathcal{O}(t^2) term is the Heisenberg model and represents super exchange which leads to effective spin flips.
 
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