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Trace-class Gibbs normalization for a semibounded self-adjoint operator

Statement

Assume the Axiom of Choice. Let H≠{0} be a complex Hilbert space and let A be self-adjoint with regular Borel projection-valued measure E from Spectral theorem for unbounded self-adjoint operators (PVM form), with E((−∞,a))=0 for finite a∈R. For each γ>0, define the bounded Gibbs operator Kγ:=ΦE(fγ) using the bounded Borel PVM integral of Bounded borel pvm integral, where fγ(λ)=e−γλ for λ≥a and fγ(λ)=e−γa for λ<a. Fix β>0 and suppose Kβ is trace class in the sense of Trace class operator. Then Kβ is injective and has a finite or countable orthonormal basis (uj) of H with Auj=Ejuj, Ej≥a, and Kβuj=e−βEjuj. Its partition function Zβ:=Tr⁡Kβ=∑je−βEj is positive and finite, and ρβ:=Kβ/Zβ is positive with Tr⁡ρβ=1. For every B∈B(H), Tr⁡(ρβB)=∑j(e−βEj/Zβ)⟨Buj,uj⟩ absolutely. Further, let J⊂(0,∞) be open and suppose that for every compact C⊂J there is a summable family aj≥0 with (1+∣Ej∣2)e−γEj≤aj for all j and γ∈C. Then for each γ∈J, Kγ is trace class with partition function Zγ:=Tr⁡Kγ=∑je−γEj. With pj(γ):=e−γEj/Zγ, define Eˉγ:=∑jpj(γ)Ej, Var⁡γ(E):=∑jpj(γ)(Ej−Eˉγ)2, and Sγ:=−∑jpj(γ)log⁡pj(γ). These quantities are finite and satisfy −∂γlog⁡Zγ=Eˉγ, ∂γ2log⁡Zγ=Var⁡γ(E), and Sγ=log⁡Zγ+γEˉγ as in Summable canonical differentiation. Countable nonnegative sums use the finite-subsum supremum convention of Countable canonical model.

Facts & Assumptions

Given: AC, a nonzero complex Hilbert space, a self-adjoint semibounded operator, the specified Borel functional calculus, trace-class Kβ, and a bounded operator B.

[A1]

The Hilbert space is nonzero; A is self-adjoint with spectral support in [a,∞); AC is adopted; β>0; and Kβ is trace class. For the interval clause, the same list (Ej) has the local summable moment envelope stated in the theorem.

[A2]

B is a bounded operator on H.

[F1]

The Axiom of Choice and Spectral theorem for unbounded self-adjoint operators (PVM form): under AC a self-adjoint A has a regular PVM E, domain D(A)={x:∫λ2dEx<∞}, and Ax=∫λdE(λ)x.

[F2]

Bounded borel pvm integral: for bounded Borel f, K=ΦE(f) satisfies ∥Kx∥2=∫∣f∣2dEx and nonnegative f gives a positive operator.

[F3]

Spectral theorem for compact self adjoint operators and Orthonormal eigenbasis for a compact self adjoint operator: compact self-adjoint operators have finite-dimensional nonzero eigenspaces whose closed span is (ker⁡K)⊥; under AC their union has a complete orthonormal eigenbasis when ker⁡K=0.

[F4]

Trace class operator and Trace of a positive operator is the sum of its eigenvalues: positive trace-class operators are compact and their trace is the sum of their nonnegative eigenvalues with multiplicity.

[F5]

Trace is absolutely convergent and basis independent and Trace class is a two sided Banach operator ideal: the trace is basis-independent and linear in trace-class operators, and multiplying a trace-class operator by a bounded operator preserves trace class.

[F6]

Countable canonical model and Summable canonical differentiation: nonnegative countable sums are suprema of finite subsums, and the stated local moment envelope gives a finite partition sum, finite mean and variance, and the canonical derivative and entropy identities.

[F7]

Cyclicity of the trace: for trace-class S and bounded B, Tr⁡(SB)=Tr⁡(BS).

[F8]

Real and complex inner-product spaces and their induced length: the inner product is linear in the first argument and conjugate-linear in the second.

[F9]

Absolute value and singular values of a compact operator: for compact T, its positive singular values are the positive eigenvalues of the positive operator ∣T∣=(T∗T)1/2 counted with multiplicity. In particular, if T is positive then its absolute value equals T.

[F10]

Parseval equivalences for an orthonormal family: a complete orthonormal family has Parseval equality and its finite-coordinate projections converge in norm to each vector.

[F11]

The exponential is a continuous bijection from R onto (0,∞) and The exponential function is strictly increasing: the real exponential is continuous, positive, injective, and strictly increasing.

[F12]

The natural logarithm as the inverse of the exponential function: for x>0, log⁡x is the unique real y satisfying ey=x, so exp⁡(log⁡x)=x and log⁡(exp⁡y)=y.

[F13]

Integral of a simple function against a pvm, Projection valued measure, and Scalar and complex measures from a pvm: for a simple function s=∑kck1Dk in disjoint normal form, ∫s dE=∑kckE(Dk); the PVM satisfies E(B∩C)=E(B)E(C) and E(R)=I, each E(Dk) is self-adjoint with ⟨E(Dk)x,x⟩=∥E(Dk)x∥2≥0, and Ex(B)=⟨E(B)x,x⟩ is a positive countably additive measure with Ex(R)=∥x∥2.

[F14]

Cauchy–Schwarz: ∣⟨x,y⟩∣≤∥x∥ ∥y∥, with equality exactly for dependent pairs: ∣⟨x,y⟩∣≤∥x∥ ∥y∥, so inner products are continuous under norm convergence.

[F15]

Bounded finite rank operators are compact and Norm limit of compact operators is compact: bounded finite-rank operators are compact, and under AC a norm limit of compact operators into the Hilbert space H is compact.

[F16]

Monotonicity and nonnegative homogeneity of the nonnegative integral, The nonnegative integral agrees with the simple integral on simple functions, and The integral of a nonnegative simple function: the nonnegative integral is monotone and homogeneous for positive scalars, and ∫1C dμ=μ(C) for measurable C.

Proof

Given: AC, a nonzero complex Hilbert space, self-adjoint semibounded A, its spectral PVM, a parameter β>0, and trace-class Kβ.

1.1A1F1F2F11F13F14F16

Since β>0, −βλ≤−βa for λ≥a; strict increase and positivity from [F11] show that fβ is bounded and strictly positive. Each branch is continuous and their values agree at a, so fβ is Borel. For each n, partition its bounded range into finitely many intervals of length at most 1/n and take their Borel preimages; choosing a nonnegative value in each interval gives a nonnegative real simple sn converging uniformly to fβ. By [F13], Tn:=∫sn dE is a finite real linear combination of self-adjoint projections, hence self-adjoint and has nonnegative quadratic form. By [F2], Tn→Kβ in operator norm. Therefore ⟨Kβx,y⟩=⟨x,Kβy⟩ and ⟨Kβx,x⟩≥0 by [F14] and passage to the limit, so Kβ is self-adjoint and positive. If Kβx=0, [F2] gives ∫fβ2dEx=0. For each n≥1, fβ≥1/n on Cn:={λ:fβ(λ)≥1/n}; [F16] gives 0=∫fβ2dEx≥n−2Ex(Cn), so Ex(Cn)=0. The sets Cn increase to R; set D1=C1 and Dn=Cn∖Cn−1 for n>1. They are disjoint, cover R, and satisfy Ex(Dn)≤Ex(Cn)=0. Countable additivity in [F13] gives Ex(R)=∑nEx(Dn)=0, hence ∥x∥=0 and Kβ is injective.

2.1A1F3F4step 1.1

By the trace-class definition [F4], Kβ is compact; together with step 1.1 it is compact self-adjoint and positive. Apply [F3]: its nonzero eigenspaces have finite multiplicity and span (ker⁡Kβ)⊥=H, so AC supplies a finite or countable complete orthonormal family (uj) of eigenvectors with eigenvalues κj>0. By [F4], Zβ=Tr⁡Kβ=∑jκj<∞; because H≠0 and Kβ is injective, this sum is positive.

3.1A1F1F2F3F4F11F12F13F16step 2.1

Fix j. To justify the constant shift in the calculus, choose bounded simple sn→fβ uniformly. By [F13], ∫(sn−κj) dE=∫sn dE−κjI; [F2] passes both uniform limits, so ΦE(fβ−κj)=Kβ−κjI. Applying the norm identity in [F2] to this difference and the eigenvector gives ∫∣fβ−κj∣2dEuj=∥(Kβ−κjI)uj∥2=0. For every n, [F16] shows that the set where ∣fβ−κj∣≥1/n has zero Euj-measure; their union is the complement of the level set. Hence Euj is supported on fβ−1(κj)∩[a,∞)={Ej}: injectivity of the exponential gives uniqueness, and [F12] gives Ej=−β−1log⁡κj≥a. Thus ∫λ2dEuj=Ej2<∞ and [F1] yields uj∈D(A) and Auj=Ejuj.

4.1A1F1F2F4F6F8F9F10F13F14F15step 1.1step 3.1

The spectral measure of each uj is the unit mass at Ej by step 3.1. Hence ∥(I−E({Ej}))uj∥2=Euj(R∖{Ej})=0, so E({Ej})uj=uj; for Borel D not containing Ej, E(D)uj=E(D)E({Ej})uj=E(∅)uj=0 by [F13]. For every γ>0, choose nonnegative simple sn→fγ uniformly as in step 1.1. In each disjoint normal form, [F13] then gives (∫sn dE)uj=sn(Ej)uj; the uniform-limit clause of [F2] yields Kγuj=fγ(Ej)uj=e−γEjuj. Fix γ∈J and enumerate that basis; let PN project onto its first N vectors, taking PN=I once a finite basis is exhausted. Parseval gives ∥PNx∥≤∥x∥, so KγPN is bounded and finite rank. Fix the summable envelope aj for {γ}⊂J; every finite subsum of tj:=e−γEj is at most the corresponding sum of aj, hence S:=∑jtj<∞ by the finite-subsum definition [F6]. This sum is positive because the basis is nonempty and every term is positive. For ε>0, choose a finite set F with S−ε<∑j∈Ftj; once N contains F, every finite tail subsum is at most S−∑j∈Ftj<ε, so ∑j>Ntj→0. Again by Parseval, ∥(Kγ−KγPN)x∥2=∑j>Ne−2γEj∣⟨x,uj⟩∣2≤(∑j>Ne−γEj)2∥x∥2, so KγPN converges to Kγ in operator norm. For tj=e−γEj its finite diagonal expansion is KγPNx=∑j≤Ntj⟨x,uj⟩uj; orthonormality and [F8] give ⟨KγPNx,y⟩=⟨x,KγPNy⟩ and ⟨KγPNx,x⟩=∑j≤Ntj∣⟨x,uj⟩∣2≥0. Thus each truncation is self-adjoint and positive, and [F14] plus operator-norm convergence preserves both properties. It is compact by [F15], since the truncations are bounded finite-rank operators and H is Banach. Thus Kγ is compact self-adjoint and positive. Its absolute value is Kγ, by the unique positive square-root definition in [F9]. If Kγx=λx, taking coordinates in the complete basis gives (tj−λ)⟨x,uj⟩=0 for every j; thus its eigenvalues and their multiplicities are exactly the diagonal values tj. Hence [F9] identifies its positive singular values, with multiplicity, as the list (tj). Their finite subsums are bounded by ∑jaj, so the trace-class definition [F4] applies and gives Tr⁡Kγ=∑jtj.

5.1A1F5F6step 2.1step 4.1

At the fixed β, ρβ=Kβ/Zβ is positive trace class and [F5] gives Tr⁡ρβ=Zβ−1Tr⁡Kβ=1. For each γ∈J, ργ=Kγ/Zγ likewise has trace one; its eigenvalues pj=e−γEj/Zγ form the canonical law, so [F6] gives the finite mean, variance, and identity −∑jpjlog⁡pj=log⁡Zγ+γ∑jpjEj.

6.1A1A2F3F5F7F8step 5.1∎

For bounded B, [F5] makes ρβB and Bρβ trace class and [F7] gives Tr⁡(ρβB)=Tr⁡(Bρβ). Evaluate the second trace in the complete basis (uj): Tr⁡(Bρβ)=∑j⟨Bρβuj,uj⟩=∑jpj⟨Buj,uj⟩, where [F8] and real pj justify pulling the scalar out. This series is absolutely convergent since ∣⟨Buj,uj⟩∣≤∥B∥ and ∑jpj=1.

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