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Interacting Heisenberg dimer Gibbs model

Physical scope

The finite two-spin Hilbert space C^2 tensor C^2 with the isotropic Pauli exchange Hamiltonian and a uniform z-field, at positive temperature. The exact separability threshold is asserted only at zero field for J>0. There is no measurement, thermalization, material-specific, or infinite-volume claim.

Statement

Let e0,e1 and σx,σy,σz,C be as in Pauli matrices and the two-qubit exchange operator, with σze0=e0 and σze1=−e1. By Spectrum of the two-qubit Pauli exchange matrix, the normalized singlet s=(e0⊗e1−e1⊗e0)/2 has C-eigenvalue −3, and the three orthonormal triplets have eigenvalue 1. Adopt the two-spin Hamiltonian as a finite matrix on C2⊗C2, with full domain D(HJ,h)=C2⊗C2: HJ,h:=JC−h(σz⊗I+I⊗σz), where J,h∈R are energies in joules. For inverse temperature β>0 in J−1, use the canonical Gibbs preparation only after normalizing its finite trace. Its singlet energy is −3J; its triplet energies are J−2h, J, and J+2h. Here cosh⁡y:=(ey+e−y)/2. Z(β,J,h)=e3βJ+e−βJ(1+2cosh⁡(2βh))>0. At h=0 and J>0, the Gibbs density matrix is entangled exactly when βJ>(log⁡3)/4, and is separable at and below equality. This exact threshold is a finite-state quantum-model conclusion. For every fixed J,h, Z and the free energy −β−1log⁡Z are real analytic for β>0; the entanglement threshold is not a finite-temperature thermodynamic singularity. At zero field the entropy tends to 0 as β→∞ for J>0, to kBlog⁡3 for J<0, and to kBlog⁡4 for J=0. For J>0, a nonzero field makes the singlet and the field-aligned triplet cross at ∣h∣=2J at zero temperature; this ground-space crossing does not make Z singular at finite positive temperature.

Facts & Assumptions

Given: The finite Hilbert space and Pauli conventions in the Statement; J,h are in joules, β>0 is in J−1, and kB>0 is in J K−1.

[A1]

Quantum statistics and model equilibrium preparation: adopt the canonical state ρ=Z−1e−βH only when its trace is finite and positive; this is a model preparation assumption, not a thermalization claim.

[F1]

Pauli matrices and the two-qubit exchange operator: C=∑j=x,y,zσj⊗σj, and each Pauli matrix acts on all of C2.

[F2]

Spectrum of the two-qubit Pauli exchange matrix: the normalized singlet has C-eigenvalue −3, while the three orthonormal triplets have eigenvalue 1.

[F3]

Finite Pauli dimer spectrum and exact separability threshold: for the zero-field two-qubit Gibbs density with dimensionless x=βJ≥0, separability holds exactly for x≤(log⁡3)/4.

[F6]

Real-analytic functions are closed under sums, products and compositions, and under quotients where the denominator is nonzero: sums, products, compatible compositions, and quotients with nonzero denominator preserve real analyticity.

[F7]

Real analytic inverse and implicit functions and The exponential function is smooth and (exp⁡)′=exp⁡: a real analytic map with nonzero derivative has a real analytic local inverse, and exp⁡′(y)=exp⁡(y).

[F8]

The natural logarithm as the inverse of the exponential function: log⁡ is the inverse of exp⁡ on (0,∞).

[F9]

The exponential dominates every fixed nonnegative integer power at +∞: for fixed Δ>0, βe−βΔ→0 as β→∞.

Proof

1.1givenF1F2algebra

In the ordered basis e0e0,e0e1,e1e0,e1e1, the field operator σz⊗I+I⊗σz has eigenvalues 2,0,0,−2. The middle two basis vectors combine into the singlet and the m=0 triplet of [F2]; both have field eigenvalue 0. The outer vectors are the m=+1 and m=−1 triplets, with field eigenvalues 2 and −2. Thus the singlet and triplet basis from [F2] is a common orthonormal eigenbasis for C and the field operator. The displayed real eigenvalues make HJ,h self-adjoint on its full domain C2⊗C2; the singlet energy is −3J and the triplet energies are J−2h,J,J+2h.

2.1givenA1F3step 1.1algebra

The canonical trace is the sum of the four positive weights associated with step 1.1. It is therefore finite and positive, and the adopted preparation [A1] gives the displayed partition function. At h=0 and J>0, setting x=βJ identifies its normalized state with ρx in [F3], so that theorem gives the exact separability and entanglement alternatives, including the equality case.

2.2A1F2F9step 1.1algebra

Fix J,h and let Emin⁡ be the least of the four energies from step 1.1, with multiplicity g. Write the other energies as Emin⁡+Δi with Δi>0. After factoring out e−βEmin⁡, the denominator is Dβ=g+∑ie−βΔi→g and 1≤Dβ≤4. The Gibbs probability of each ground vector is 1/Dβ, so the total ground entropy tends to −kBg(1/g)log⁡(1/g)=kBlog⁡g. For an excited vector, pi=e−βΔi/Dβ and −pilog⁡pi=pi(βΔi+log⁡Dβ)≤e−βΔi(βΔi+log⁡4); this tends to zero by [F9], so the finite sum of excited entropy terms vanishes. At h=0, the triplet is the three-dimensional ground space for J<0, all four levels coincide for J=0, and the singlet is the unique ground state for J>0, giving the stated limits.

3.1givenF4F5F6F7F8step 1.1step 2.1

Fix J,h and any β0>0. For each of the four energies E from step 1.1, the addition formula [F4] gives e−βE=e−β0E∑n≥0[−E(β−β0)]n/n!, a convergent power series about β0. The four-term sum Z(β) is therefore real analytic near β0 by [F5]–[F6], and Z(β0)>0 by step 2.1. Put y0=log⁡Z(β0). By [F8], exp⁡(y0)=Z(β0); by [F7], exp⁡′(y0)=exp⁡(y0)=Z(β0)≠0. The real analytic inverse theorem gives a local analytic inverse to exp⁡ near Z(β0), and [F8] identifies that inverse with log⁡. The composition clause of [F6] now makes log⁡Z real analytic near β0. Since β0 was arbitrary, −β−1log⁡Z is real analytic for every β>0: the identity and constant functions have local polynomial series, so the quotient clause of [F6] makes β↦β−1 analytic on this domain. Thus the finite-volume free energy has no singularity at the entanglement threshold.

4.1givenstep 1.1step 2.1algebra∎

For J>0, the lowest triplet energy is J−2∣h∣. It equals the singlet energy −3J exactly at ∣h∣=2J. The two energy levels can cross as parameters vary, but step 2.1 is a strictly positive finite sum of exponentials at every β>0, so this zero-temperature ground-space crossing creates no finite-temperature singularity.

Depends on

Dependency tree · 2 levels

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