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Qm Math Fock And Equilibrium — Examples

1 · Prerequisites

2 · Summary

The companion page to qm-math-fock-and-equilibrium records three explicit mathematical checks on its equilibrium and exclusion statements. All three items are mathematics: they carry domain: mathematics, depend only on the parent page, earlier mathematical suppliers and published mathematics, and make no physical or empirical claim.

Infinite identical-mode divergence takes the degenerate mode list εj=ε0>0 on a separable infinite-dimensional one-particle space: the weight sum ∑je−βεj diverges, the partial products (1−e−βε0)−N grow at least like eNe−βε0, and the diagonal weight operator Dβ of Countable-mode product criterion is not trace class, while a single mode of the same frequency has the finite trace 1/(1−e−βε0) by Single-mode thermal trace; the divergence is caused by the infinite multiplicity, not by the value of the frequency.

No automatic equilibration exhibits the non-stationary unit vector ψ0=(e0+e1)/2 of the one-mode Fock space: under the unitary group generated by ωN the state keeps returning to itself, the expectation of A+(1)+A−(1) equals cos⁡(ωt/ℏ) and has no limit, and the state has no norm limit, whereas the weight operator Gβ of Single-mode thermal trace is invariant under the same dynamics; unitary evolution alone therefore does not equilibrate a non-stationary state.

Repeated-orbital fermion exclusion verifies concretely that P−(2)(u⊗u)=0 for every u because the transposition fixes u⊗u, that the Slater vector with a repeated orbital is the zero vector (so the norm-one statement of Slater direct and exchange calculation genuinely needs orthonormal orbitals), and that exclusion survives for the non-basis vector u=e1+e2 in C2: it is a property of the state, not of basis labels.

3 · Logical flowchart

4 · Definitions, postulates, theorems and proofs

None yet.

5 · Examples, experiments and counterexamples

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Infinite identical-mode divergence

Example

Assume the Axiom of Countable Choice and the Axiom of Choice. Let H be a separable infinite-dimensional complex Hilbert space with complete orthonormal family (ej)j≥1, let ε0>0, β>0, and consider the degenerate mode list εj:=ε0(j≥1) (infinitely many modes of one and the same positive frequency). Adopt the notation F(H), M, vI, λI, uI, Dβ of Countable-mode product criterion. This example verifies concretely that:

(a) the one-particle weight sum diverges for every β>0, ∑j≥1e−βεj=∑j≥1e−βε0=+∞, so the product criterion of Countable-mode product criterion (d) is violated;

(b) the grand-canonical weights do not converge: for every N≥1 ∑I∈MI⊆{1,…,N}e−βλI=∏j=1N11−e−βε0=(1−e−βε0)−N, and these partial products increase to +∞; quantitatively (1−e−βε0)−N≥eNe−βε0 for every N;

(c) consequently ∑I∈Me−βλI=+∞, the diagonal operator Dβ is not trace class, and there is no finite grand-canonical partition sum tr⁡Dβ for this mode list;

(d) the divergence is caused by the infinite multiplicity of the frequency, not by its value: for the one-mode space H=C with frequency ω=ε0>0, Single-mode thermal trace gives the finite value Z(β)=1/(1−e−βω) of the trace of the weight operator, whereas the countable product of these one-mode factors diverges here.

No thermodynamic interpretation of β, of Dβ or of the divergence is asserted; the example is a statement about the convergence of the displayed series for a degenerate mode list.

Verification

Given: the separable infinite-dimensional H with complete orthonormal family (ej)j≥1, the constant mode list εj=ε0>0, β>0, and the objects M,vI,λI,Dβ of Countable-mode product criterion.

[F1] For every N≥1, ∑I∈M, I⊆{1,…,N}e−βλI=∏j=1N(1−e−βεj)−1, and ∑I∈Me−βλI<+∞ if and only if ∑j≥1e−βεj<+∞, in which case the sum equals the infinite product; 0<e−βεj<1 (Countable-mode product criterion (c), (d)).

[F2] Dβ is trace class exactly when ∑I∈Me−βλI<+∞, and then tr⁡Dβ equals that sum (Countable-mode product criterion (b), (e)).

[F3] If a series of reals converges then its terms tend to 0; contrapositively, a series whose terms do not tend to 0 diverges (If a series converges then its terms tend to 0, Series and absolute convergence in a normed space).

[F4] For 0<x<1, put y=(1−x)−1>1. The integral inequalities give x=1−1/y≤log⁡y, and the reciprocal law of the natural logarithm gives log⁡(1−x)=−log⁡y≤−x; the supplier also gives the product law log⁡(xy)=log⁡x+log⁡y; log⁡ is increasing and is inverse to the real exponential (The natural logarithm has derivative 1/x and equals the integral from 1 to x of 1/t, If f≤g on [a,b] and both are integrable then ∫abf≤∫abg; and m(b−a)≤∫abf≤M(b−a), Order, continuity, range, and the product, quotient, and reciprocal laws for the natural logarithm).

[F5] For the one-mode space F(C) with frequency ω>0 and β>0, Z(β)=∑n≥0e−βωn=1/(1−e−βω) and the weight operator Gβen=e−βωnen is trace class with tr⁡Gβ=Z(β)<∞ (Single-mode thermal trace (b), (c)).

1.1F3algebra

[Divergence of the one-particle weights] By the definition of the mode list, e−βεj=e−βε0>0 for every j, a constant strictly positive sequence that does not converge to 0; by [F3] the series ∑je−βεj diverges, and since all its terms are positive its value is +∞. This is (a).

1.2F1F4algebra

[Divergent partial products and the finite-N identity] By [F1] applied to the constant list, for every N≥1, ∑I⊆{1,…,N}e−βλI=∏j=1N(1−e−βε0)−1=(1−e−βε0)−N. Since 0<1−e−βε0<1, these finite powers strictly increase. Put x:=e−βε0∈(0,1). By [F4] and the logarithm product and reciprocal laws, log⁡((1−x)−N)=−Nlog⁡(1−x)≥Nx, so monotonicity of log⁡ gives (1−x)−N≥eNx. For any M>0, choose r:=log⁡M/x; if N>r, then Nx>log⁡M, hence eNx>M because the exponential is the increasing inverse of log⁡. Thus the partial products tend to +∞, proving the quantitative bound in (b).

2.1F1F2step 1.1step 1.2

[Divergence of the grand-canonical weights, no trace] By step 1.1 the series ∑je−βεj is not finite, so the equivalence in [F1] gives ∑I∈Me−βλI=+∞; by step 1.2 its finite partial sums are finite and increasing, consistently. By [F2], Dβ is not trace class and tr⁡Dβ does not exist as a finite number. This is (c).

2.2F5step 1.2algebra

[The single-mode contrast] For H=C with ω=ε0, [F5] gives Z(β)=1/(1−e−βω)<∞ and a trace-class weight operator with trace Z(β); the same closed-form expression appears in step 1.2 with each of the infinitely many factors equal to it, and step 1.2 proves that these constant-factor products diverge by the quantitative bound (1−e−βω)−N≥eNe−βω→+∞. Thus the infinite multiplicity, not the value of the positive frequency, produces the divergence. This is (d).

3.1step 1.1step 1.2step 2.1step 2.2∎

[Conclusion and scope] Steps 1.1-1.2 prove (a) and (b), step 2.1 proves (c), and step 2.2 proves (d). The scope paragraph of the example records that no thermodynamic interpretation of β, Dβ or the divergence is asserted. This completes the verification.

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No automatic equilibration

Example

Assume the Axiom of Countable Choice and the Axiom of Choice. Let ω>0, ℏ>0, let F(C) be the one-mode Fock space with its complete orthonormal family (en)n∈N, number operator N and operators A±(1) as in Fixed-mode number law and Number operator domain, and let A:=ωN,U(t):=e−itA/ℏ=∫Re−itλ/ℏ dE(λ), the unitary group generated by the self-adjoint A with spectral projection valued measure E (Spectral theorem for unbounded self-adjoint operators (PVM form), A self-adjoint operator generates a strongly continuous unitary group). Put ψ0:=e0+e12,ψ(t):=U(t)ψ0,Y:=A+(1)+A−(1),D(Y):=D(A+(1))∩D(A−(1)). Then ∥ψ0∥=1, ψ(t)∈D(Y) for every t, and with θ:=ωt/ℏ:

(a) ψ(t)=e0+e−iθe12;

(b) the expectation t↦⟨ψ(t),Yψ(t)⟩ equals cos⁡(ωt/ℏ); consequently it tends to no limit as t→+∞, since it equals 1 at t=2πℏn/ω and −1 at t=(2n+1)πℏ/ω;

(c) the state itself has no norm limit: ∥ψ(t)−ψ(s)∥2=1−cos⁡(ω(t−s)/ℏ), so ∥ψ(tn)−ψ(sn)∥=2 for the two sequences of (b);

(d) in contrast, the weight operator Gβ and the density operator ρβ=Gβ/Z(β) of Single-mode thermal trace are invariant under the same dynamics: U(t)GβU(t)∗=Gβ,U(t)ρβU(t)∗=ρβ(t∈R, β>0).

Thus a stationary equilibrium weight is available on this space, but the unitary dynamics of the non-stationary unit vector ψ0 produces no convergence of the state or of the displayed expectation: equilibration is not a consequence of unitary evolution alone. No physical interpretation of ψ0, Y, β or ρβ is asserted; in particular no thermal state is derived, and the example does not assert that any physical preparation oscillates.

Verification

Given: the one-mode Fock space F(C) with complete orthonormal family (en)n∈N, the self-adjoint ωN, its unitary group U(t), the vector ψ0, the symmetric operator Y=A+(1)+A−(1) and the objects Gβ,ρβ,Z(β) of Single-mode thermal trace.

[F1] A:=ωN is self-adjoint on D(N), N≥0, Nen=nen, and the eigenvalues of N on F(C) are exactly N, each with eigenvector en; D(N)⊆D1:={ψ:∑n(n+1)∥ψn∥2<∞}, and F0 is dense (Number operator domain (a), (b), (d), Hilbert direct-sum construction (c)).

[F2] Oscillator coefficients (in particular en∈D(A+(1))∩D(A−(1)) for every n, as required by these operator equalities): A+(1)en=n+1 en+1 and A−(1)en=n en−1 for n≥1, A−(1)e0=0 (Fixed-mode number law (a)); (en) is a complete orthonormal family of F(C) (Fixed-mode number law, Orthonormal families, complete orthonormal systems and Hilbert bases).

[F3] Spectral calculus: for a self-adjoint operator T with PVM ET and x∈D(T), ∥(T−a)x∥2=∫(λ−a)2 dETx(λ); for bounded Borel h the operator h(T) is bounded with ∥h(T)x∥2=∫∣h∣2 dETx; if additionally ∫∣h−h(λ0)∣2dETx=0 then h(T)x=h(λ0)x; and UT(t)=e−itT/ℏ is a strongly continuous unitary group expressed by the functional calculus (Spectral theorem for unbounded self-adjoint operators (PVM form), Unbounded Borel functional calculus: domains, products, spectral mapping, Projection valued measure, Integral of a measurable function against a projection-valued measure, A self-adjoint operator generates a strongly continuous unitary group).

[F4] A nonnegative measurable function has zero integral exactly when it vanishes almost everywhere w.r.t. the measure (A nonnegative measurable function has integral 0 exactly when it vanishes almost everywhere).

[F6] Gβ is bounded self-adjoint, Gβ=⨁n∈Ne−βωnid on the Fock sectors, Z(β)=1/(1−e−βω), and ρβ=Gβ/Z(β) (Single-mode thermal trace (a), (b), (d)).

[F7] Limits at +∞: if a function has a limit then every sequence tending to +∞ has that limit (Limits at +∞ and −∞, and infinite limits at a point).

1.1F1F3F4algebra

[U(t) on eigenstates] For n∈N the vector en satisfies Nen=nen by [F1], hence Aen=ωnen; by [F3] with T=A, a=ωn and x=en, ∫(λ−ωn)2dEen=0 with a nonnegative integrand, so by [F4] the measure Een gives full mass to {ωn}. Applying [F3] to the bounded Borel function hn(λ):=e−itλ/ℏ and λ0=ωn gives ∥hn(A)en−e−itωn/ℏen∥2=∫∣hn−hn(ωn)∣2dEen=0; hence U(t)en=hn(A)en=e−itωn/ℏen. For n∈{0,1} this gives U(t)e0=e0 and U(t)e1=e−iθe1, so by linearity ψ(t)=(e0+e−iθe1)/2, which is (a); also ∥ψ0∥2=(∥e0∥2+∥e1∥2)/2=1.

2.1F2F5step 1.1algebra

[The expectation] By [F2], Ye0=A+(1)e0=e1 and Ye1=A−(1)e1+A+(1)e1=e0+2 e2, so Y maps span⁡{e0,e1} into span⁡{e0,e1,e2}; since e0,e1∈D(A+(1))∩D(A−(1)) by the operator equalities in [F2] and both domains are linear subspaces, both ψ(t) and Yψ(t) lie in the finite-particle space, and ⟨ψ(t),Yψ(t)⟩ is well-defined. With Yψ(t)=12(e1+e−iθe0+2e−iθe2), orthonormality of (e0,e1,e2) and linearity in the first argument give ⟨ψ(t),Yψ(t)⟩=12(⟨e0,e1⟩+eiθ⟨e0,e0⟩+e−iθ⟨e1,e1⟩)=12(eiθ+e−iθ)=cos⁡θ.

2.2F2F6step 1.1algebra

[The stationary thermal weight] By [F6], Gβ is the direct sum of the scalars e−βωn on the one-dimensional sectors of F(C); since the sector n is spanned by en, this says Gβen=e−βωnen, so Gβ is diagonal in the complete orthonormal family (en). By step 1.1, U(t)GβU(t)∗en=U(t)Gβeiθnen=eiθne−βωne−iθnen=e−βωnen=Gβen for every n, θn=ωnt/ℏ. Both U(t)GβU(t)∗ and Gβ are bounded and agree on the complete orthonormal family, hence on its dense span, hence everywhere; dividing by the finite positive scalar Z(β) gives U(t)ρβU(t)∗=ρβ. This is (d).

3.1F5F7step 1.1step 2.1

[Failure of convergence of the expectation and of the state] By step 2.1, ⟨ψ(t),Yψ(t)⟩=cos⁡(ωt/ℏ) equals 1 at tn=2πℏn/ω and −1 at sn=(2n+1)πℏ/ω for every n; if a limit existed along t→+∞, [F7] would give 1=−1, a contradiction. This is (b). For two times t,s, [F5] gives ∥ψ(t)−ψ(s)∥2=12∣e−iωt/ℏ−e−iωs/ℏ∣2=1−cos⁡(ω(t−s)/ℏ), which equals 2 for t=tn, s=sn; hence the family (ψ(t)) is not Cauchy at +∞ and has no limit in norm. This is (c).

4.1step 1.1step 2.1step 3.1step 2.2∎

[Conclusion and scope] Steps 1.1 and 2.1 establish the setting and the expectation cos⁡(ωt/ℏ), step 3.1 proves (b) and (c), and step 2.2 proves (d). The scope paragraph of the example records that no physical interpretation of the state, the coupling or the weights is asserted and that relaxation to equilibrium is not derived. This completes the verification.

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Repeated-orbital fermion exclusion

Example

Slot convention. For ℓ≥1, Sℓ acts on {0,…,ℓ−1} as in Permutation sector projections on the n-fold tensor power. On one-based tuple positions use π^(k):=1+π(k−1) for 1≤k≤ℓ. Conjugation by k↦k−1 gives πσ^=π^∘σ^ and π−1^=π^−1; thus the supplier's tensor action becomes Uπ(v1⊗⋯⊗vℓ)=vπ^−1(1)⊗⋯⊗vπ^−1(ℓ). The parameters of Uπ and sgn⁡(π) remain canonical zero-based permutations.

Assume the Axiom of Countable Choice and the Axiom of Choice. Let H be a complex Hilbert space, let H⊗n be its completed tensor powers with the unitaries Uπ and projections P±(n) of Permutation sector projections on the n-fold tensor power. Fix n≥2 and vectors u1,…,un∈H, and let S(u1,…,un):=1n!∑σ∈Snsgn⁡(σ) uσ^(1)⊗⋯⊗uσ^(n) be the Slater vector of Slater direct and exchange calculation. This example verifies concretely that:

(a) for every u∈H the antisymmetrised two-particle tensor vanishes, P−(2)(u⊗u)=0, because the canonical transposition τ=(0 1)∈S2 of the two tensor factors satisfies Uτ(u⊗u)=u⊗u and P−(2)=12(id−Uτ);

(b) consequently the Slater vector with a repeated orbital is the zero vector, S(u,u)=12(u⊗u−u⊗u)=0(u∈H), and the norm-one conclusion of Slater direct and exchange calculation (a) does not apply to the degenerate list (u,u): orthonormality of u1,…,un is an essential hypothesis, not a convenience; for orthonormal u1,u2 one has ∥S(u1,u2)∥=1;

(c) exclusion is a property of the state and not only of basis labels: for H=C2 with orthonormal basis e1,e2 and the non-basis vector u:=e1+e2 the antisymmetric part still vanishes. Indeed u⊗u=e1⊗e1+e1⊗e2+e2⊗e1+e2⊗e2, and P−(2) annihilates the two diagonal tensors while exchanging the two crossed tensors with opposite sign, so P−(2)(u⊗u)=0;

(d) in the actual tensor space H⊗2, the two-particle antisymmetric sector ran⁡P−(2) contains no nonzero vector of the form P−(2)(u⊗u): every repeated-orbital projection is zero, and zero belongs to this sector as it does to every linear subspace. Thus a nonvanishing antisymmetric two-particle vector cannot be built from two copies of the same one-particle vector. This sector is distinct from the symmetric two-particle sector of the bosonic F(H) in Hilbert direct-sum construction.

The antisymmetric sector and its projection are mathematical objects; as recorded in the cited suppliers, selecting this sector for a species is a postulate and no spin-statistics statement is proved here.

Verification

Given: the complex Hilbert space H, its completed tensor powers H⊗n, the permutation unitaries Uπ and the projections P±(n), the transposition τ∈S2, the vector u=e1+e2∈C2 and the orthonormal family (e1,e2).

[F1] For every π∈Sn there is a unique unitary Uπ with Uπ(v1⊗⋯⊗vn)=vπ^−1(1)⊗⋯⊗vπ^−1(n), Uπ∗=Uπ−1; for n=2 and the transposition τ one has τ−1=τ and Uτ(v1⊗v2)=v2⊗v1. Moreover P−(2)=12(id−Uτ), and Uτ(u⊗u)=u⊗u (Permutation sector projections on the n-fold tensor power (a), (b), Hilbert tensor construction: inner product, completion and product bases).

[F2] S(u1,u2)=12(u1⊗u2−u2⊗u1)=2 P−(2)(u1⊗u2), and ∥S(u1,u2)∥=1 whenever u1,u2 are orthonormal; for u1=u2=u the two summands coincide, so the alternating sum vanishes (Slater direct and exchange calculation (a), Orthonormal families, complete orthonormal systems and Hilbert bases).

[F3] The actual two-particle antisymmetric sector is ran⁡P−(2)⊆H⊗2, a closed linear subspace and hence containing zero (Permutation sector projections on the n-fold tensor power (b)). The source F(H) is the symmetric bosonic direct sum, whose two-particle sector is ι2(ran⁡P+(2)), not the antisymmetric sector (Hilbert direct-sum construction).

1.1F1algebra

[The two-particle exclusion] For u∈H the swap identity Uτ(u⊗u)=u⊗u of [F1] gives P−(2)(u⊗u)=12(u⊗u−Uτ(u⊗u))=0. This is (a).

2.1F2step 1.1algebra

[Slater vector with repeated orbital] By [F2] with u1=u2=u, S(u,u)=12(u⊗u−u⊗u)=0; equivalently S(u,u)=2P−(2)(u⊗u)=0 by step 1.1. For orthonormal u1,u2, [F2] gives ∥S(u1,u2)∥=1, so the hypothesis of pairwise orthonormal orbitals in [F2] cannot be dropped. This is (b).

2.2F1step 1.1algebra

[Superposition check] Let u=e1+e2∈C2. Bilinearity of the tensor product gives u⊗u=e1⊗e1+e1⊗e2+e2⊗e1+e2⊗e2. By [F1], Uτ fixes e1⊗e1 and e2⊗e2 and interchanges e1⊗e2 with e2⊗e1; hence P−(2)(u⊗u)=12((e1⊗e2+e2⊗e1)−(e2⊗e1+e1⊗e2))=0, in agreement with step 1.1. This is (c).

2.3F3step 1.1algebra

[Consequence in the antisymmetric sector] If u≠0 then u⊗u≠0 (the tensor product of nonzero vectors has norm ∥u∥2>0), while step 1.1 gives P−(2)(u⊗u)=0; so no nonzero two-particle antisymmetric vector arises by antisymmetrising u⊗u. By [F3] this is a statement about the sector ran⁡P−(2) of H⊗2 ; the zero projection belongs to that linear sector, but no nonzero vector of that form exists. The bosonic F(H) has the distinct symmetric sector of [F3]. This is (d).

3.1step 1.1step 2.1step 2.2step 2.3∎

[Conclusion and scope] Steps 1.1 and 2.1 prove (a) and (b), step 2.2 proves (c), and step 2.3 proves (d). The scope paragraph of the example records that the symmetric/antisymmetric sector assignment is a postulate and that no spin-statistics statement is proved. This completes the verification.

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