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Finite free-cube grand pressure for stable power-tempered pair potentials

Statement

Assume ACω and let d≥1. Let ϕ be a stable, power-tempered pair potential as in Stable power-tempered pair-potential model, with constants B,C,R,ϵ as there. Fix activity a>0 and inverse-energy parameter β>0 in fixed reference units. Use the free-boundary grand partition sums ΞL(a,β) defined in Stability gives finite grand normalization and an exponential particle cutoff. For L≥1, put pL(a,β):=L−dlog⁡ΞL(a,β). Then the limit p(a,β):=lim⁡L→∞pL(a,β) exists as a finite real number. The assertion is for cubes with free boundary and the displayed power-tail hypothesis.

Facts & Assumptions

Given: ACω, d≥1, a stable power-tempered pair potential, a,β>0, and the free-cube partitions in Stability gives finite grand normalization and an exponential particle cutoff.

[F1]

Stable power-tempered pair-potential model defines UN, stability, and the power-tail bound: for ∥x∥2≥R, ϕ(x) is real and its real absolute value ∣ϕ(x)∣ is at most C∥x∥2−d−ϵ.

[F2]

Stability gives finite grand normalization and an exponential particle cutoff gives the exact grand partition definition, 1≤ΞL≤eQLd, and the particle-cutoff lower bound, where Q=aeβB.

[F3]

Power tempering bounds interactions between separated cubes gives the uniform bound D≤(C/2)Mn2Sd,ϵg−d−ϵ on all cross-cube energies.

[F4]

Measure space and integral defines the local nonnegative integral as the supremum over simple minorants; that current batch-11 carrier is a draft definition with its interface inspected. The local bridge The thermodynamics measure integral agrees with the shared nonnegative integral proves that this integral agrees with the shared nonnegative Lebesgue integral. This is the interface needed to apply the published Tonelli theorem to the partition integrals.

[F5]

Tonelli's theorem for nonnegative measurable functions on a sigma-finite product states that for sigma-finite measure spaces and a nonnegative product-measurable function, the product integral equals either iterated integral. The Euclidean product Borel theorem The Borel product of R^m and R^n is the Borel sigma-algebra of R^{m+n} ensures the finite-configuration integrand is product-measurable.

[F7]

Lebesgue outer measure, Lebesgue measurability and Lebesgue measure are unchanged by translation preserves each cube integral under a common translation of its particle coordinates. The corresponding finite product measure is translation-invariant by the rectangle formula and uniqueness in [F6].

[F10]

Integer part: for every real x there is exactly one integer m with m≤x<m+1 gives an integer m with m≤x<m+1 for every real x.

[F11]

Factorials satisfy 0!=1 and the recursion (N+1)!=(N+1)N! (The factorial n! and the falling factorial nk‾, defined by recursion in N).

[A1]

Since pL is defined for L≥1, write lim sup⁡L→∞pL:=inf⁡T≥1sup⁡L≥TpL,lim inf⁡L→∞pL:=sup⁡T≥1inf⁡L≥TpL. These are finite because [F2] bounds pL in [0,Q].

Proof

1.1givenF9F10construct

Set α:=12(1+d/(d+ϵ)) and gℓ:=ℓα. Then d/(d+ϵ)<α<1 and ℓdgℓ−d−ϵ=ℓd−α(d+ϵ)→0 while gℓ/ℓ→0. Fix a sufficiently large ℓ≥1 so that gℓ≥R. For L≥ℓ+gℓ, set mL:=⌊L/(ℓ+gℓ)⌋. Since L/(ℓ+gℓ)≥1, [F10] gives mL≥1 and mL(ℓ+gℓ)≤L<(mL+1)(ℓ+gℓ). Place ML=mLd cubes Cj=(ℓ+gℓ)j+[0,ℓ]d,j∈{0,…,mL−1}d. They lie inside [0,L]d and have pairwise gaps at least gℓ.

2.1F1F4F6F11givenstep 1.1algebra

First, if T is a bijection whose map and inverse are measurable and that preserves measure, meaning μ(T−1A)=μ(A) for every measurable A, then μ(TA)=μ(A) as well by applying this identity to TA; thus T−1 also preserves measure. Such a map preserves nonnegative integrals: for an indicator 1A, ∫1A∘T dμ=μ(T−1A)=μ(A)=∫1A dμ; finite sums give the same equality for simple functions. If f≥0 is measurable, composition with T sends every simple minorant of f to a simple minorant of f∘T with the same simple integral. Taking the supremum in [F4] gives ∫f dμ≤∫f∘T dμ, and applying this inequality to T−1 and f∘T gives equality. The same supremum definition shows monotonicity: f≤h implies ∫f dμ≤∫h dμ. For N≥1 identical Lebesgue factors, a coordinate permutation preserves the finite product measure: the permutation is a Borel isomorphism, so its push-forward is sigma-finite, and that push-forward agrees with the original measure on rectangles by the rectangle formula in [F6]; finite-product uniqueness, obtained by iterating the uniqueness clause in [F6], makes the measures equal. When N=0, there is one empty configuration and one empty assignment, so the equality is immediate. Now fix occupancies 0≤Nj≤nℓ with total N=∑jNj. The ordered configurations in the disjoint cubes with exactly these occupancies are partitioned by assignments of the N particle labels to cubes. The number of assignments is N!/(∏jNj!): order all N labels, then note that each assignment occurs exactly ∏jNj! times from within-cube reorderings. Any two such assignments differ by a permutation of the N labels, and the corresponding coordinate permutation maps one assignment domain to the other. The potential is even, so UN is invariant under particle-coordinate permutations. The integral invariance just proved therefore makes the assignment-domain integrals equal.

2.2F1F2F3givenstep 1.1algebra

Restrict the grand partition sum in [0,L]d to configurations with no particles outside these cubes and at most nℓ particles in each cube, where nℓ is the cutoff from [F2]. If two cubes have index difference k≠0, the coordinate gap in a coordinate attaining ∥k∥∞ is at least ∥k∥∞gℓ; [F3] therefore bounds the total absolute inter-cube energy by DL≤C2MLnℓ2Sd,ϵgℓ−d−ϵ. Thus UN=∑jUNj(j)+Ucross with Ucross≤DL, and e−βUN≥e−βDL∏je−βUNj(j); this remains true when an internal energy is +∞, since both sides then vanish.

3.1F2F4F5F6F7F8step 2.1step 2.2algebra

On each assignment domain from step 2.1, the pointwise lower bound in step 2.2 factors into nonnegative within-cube integrands. Monotonicity from step 2.1 and repeated application of [F5] and the rectangle formula in [F6] factor the resulting lower bound's integral into the product of the translated one-cube integrals. For a cube indexed by j with Nj≥1, common translation by (ℓ+gℓ)j is a Borel isomorphism mapping [0,ℓ]dNj onto CjNj and preserves its finite product measure: the push-forward is sigma-finite and, on rectangles, this follows from single-coordinate translation invariance [F7] and the rectangle formula [F6]; uniqueness in [F6] gives equality of the product measures. Pair differences, hence the within-cube integrand, are unchanged by this translation, so the integral invariance proved in step 2.1 identifies the integral over CjNj with its origin-centered integral over [0,ℓ]dNj. When Nj=0, the corresponding factor is Zℓ,0=1. Multiplying by aN/N! cancels the label count from step 2.1, leaving e−βDL∏jZℓ,Nj. Summing over the finitely many occupancy vectors and expanding the finite product of cutoff sums from [F2] gives ΞL≥e−βDL(Ξℓcut)ML.

4.1A1F2F9step 1.1step 2.2step 3.1algebra

The integer-part bounds in step 1.1 give L/(ℓ+gℓ)−1<mL≤L/(ℓ+gℓ), so mL/L→(ℓ+gℓ)−1 and ML/Ld→(ℓ+gℓ)−d. By [F2], Ξℓcut≥(1−e−ℓd)Ξℓ, so log⁡Ξℓcut≥ℓdpℓ+log⁡(1−e−ℓd). Taking logarithms in step 3.1, dividing by Ld, and using step 2.2 gives pL≥MLLd(ℓdpℓ+log⁡(1−e−ℓd)−βC2nℓ2Sd,ϵgℓ−d−ϵ). Taking the lower limit and using the volume ratio above yields the same bound with ML/Ld replaced by (ℓ+gℓ)−d. The cutoff definition [F2] and ℓ≥1 give nℓ≤Kℓd+1≤(K+1)ℓd. Factoring (ℓ/(ℓ+gℓ))d and using this estimate in the negative error term therefore gives lim inf⁡L→∞pL≥(ℓℓ+gℓ)d[pℓ+ℓ−dlog⁡(1−e−ℓd)−βC2(K+1)2Sd,ϵℓdgℓ−d−ϵ].

5.1F2F9step 1.1step 4.1algebra

As ℓ→∞, the prefactor tends to 1. Also e−ℓd→0, so continuity of log⁡ at 1 gives log⁡(1−e−ℓd)→0; since ℓ−d→0, their product ℓ−dlog⁡(1−e−ℓd) tends to zero. The cross-energy error tends to zero because d−α(d+ϵ)<0 by step 1.1. The replacement of the prefactor times pℓ by pℓ has error at most Q[1−(ℓ/(ℓ+gℓ))d]→0 by [F2]. Thus for every η>0 there is T such that every ℓ≥T makes the right side of step 4.1 at least pℓ−η.

6.1A1step 5.1choosealgebra

Let p‾=lim sup⁡ℓ→∞pℓ. By [A1], for every η>0 and every T≥1 there is an ℓ≥T with pℓ>p‾−η; otherwise the tail supremum from T onward would be at most p‾−η, contradicting the infimum defining p‾. Choose T large enough for step 5.1. Then lim inf⁡L→∞pL≥p‾−2η. Letting η↓0 shows lim inf⁡pL≥lim sup⁡pL.

7.1A1F2step 6.1algebra∎

For any S,T≥1, choose L≥max⁡(S,T). Then inf⁡x≥Spx≤pL≤sup⁡x≥Tpx. Taking the supremum over S and then the infimum over T proves lim inf⁡pL≤lim sup⁡pL by [A1]. Together with step 6.1, the two finite tail bounds equal a number p. For every η>0, their definitions give tail thresholds with inf⁡L≥T−pL>p−η and sup⁡L≥T+pL<p+η; hence ∣pL−p∣<η for all sufficiently large L. The limit is finite by [F2]. This proves existence for the specified free-cube reduced grand pressure.

Remarks

The proof uses fixed free-boundary cubes. It does not establish a canonical fixed-density limit, arbitrary-boundary independence, or the corresponding result for every decreasing integrable tail. In particular, stability alone does not enter as a claim about arbitrary van Hove shapes; those are separate interfaces with additional hypotheses. The displayed pressure is per reference volume and is the reduced pressure (the classical pressure multiplied by β). If L is measured in units of a reference length ℓ0 and β is the numerical inverse temperature in units E0−1, then the physical pressure is P=E0p/(βℓ0d). Without that specified classical interpretation, this theorem asserts only the mathematical existence of the reduced limit.

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