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Equivalence criterion for D-optimal approximate designs

Statement

Let X be a finite nonempty candidate set, f:X→Rp, and let ξ∗ be a nonsingular approximate design as in Approximate designs and linear-model optimality criteria. Write M∗=M(ξ∗) and u∗(x)=f(x)T(M∗)−1f(x). Then ξ∗ is D-optimal among nonsingular approximate designs if and only if u∗(x)≤p for every x∈X. Whenever this holds, u∗(x)=p for every x∈supp⁡(ξ∗). No existence of a nonsingular optimum is asserted.

Facts & Assumptions

Given: A finite nonempty X, p≥1, a regression-vector map f, a nonsingular approximate design ξ∗, and its matrix M∗.

[F1]

Approximate designs and linear-model optimality criteria: M(ξ)=∑x∈Xξxf(x)f(x)T for an approximate design ξ.

[F2]

Approximate designs and linear-model optimality criteria: D-optimality maximizes log⁡det⁡M(ξ) among nonsingular designs.

[F3]

The log determinant is concave on positive-definite matrices: for positive-definite A0,A1, log⁡det⁡((1−t)A0+tA1)≥(1−t)log⁡det⁡A0+tlog⁡det⁡A1 for 0≤t≤1.

[F5]

The trace tr⁡(A) as the sum of the diagonal entries: tr⁡(A) is the sum of the diagonal entries of A.

[F6]

Deleted-row-and-column minors, cofactors, the cofactor matrix and the adjugate over a commutative ring: for a positive-sized square matrix, the cofactors are signed deleted-row-and-column minors and adj⁡(A)=cof⁡(A)T.

[F7]

Laplace expansion computes the determinant along every row and every column over a commutative ring: for a positive-sized square matrix over a commutative ring, determinant expansion along any row or column is the sum of entries times their corresponding cofactors.

[F8]

For every positive-sized square matrix over a commutative ring, Aadj⁡(A)=adj⁡(A)A=det⁡(A)I: for a positive-sized square matrix over a commutative ring, Aadj⁡(A)=adj⁡(A)A=det⁡(A)I.

[F9]

The natural logarithm has derivative 1/x and equals the integral from 1 to x of 1/t gives log⁡′(r)=1/r for r>0; The chain rule for total derivatives: D(g∘f)(a)=Dg(f(a))∘Df(a) composes it with the determinant differential and affine matrix paths, using the entrywise Euclidean coordinates on real matrix space. Thus, along an affine path At=A+tH with positive determinant, (log⁡det⁡At)′=tr⁡(At−1H) by [F4]. Determinant continuity keeps its positive value in the logarithm domain locally at every path point.

Proof

technique · use feasible directional derivatives for necessity and concavity for sufficiency
1.1givenF1choosealgebra

Fix x∈X and let δx be the design putting weight 1 at x. For 0≤t<1, ξt=(1−t)ξ∗+tδx has matrix Mt=(1−t)M∗+tf(x)f(x)T, which is positive definite because M∗ is positive definite and f(x)f(x)T is positive semidefinite.

1.2givenF1F3F4F6F7F8F9choosealgebra

Conversely, suppose u∗(x)≤p for every candidate. Let η be any nonsingular approximate design and put N=M(η). The segment Ms=(1−s)M∗+sN is positive definite; by [F3], g(s)=log⁡det⁡Ms is concave. By [F4], with its cofactor and adjugate support [F6], [F7], and [F8], and the logarithm-chain rule [F9], and by [F1], g′(0)=tr⁡((M∗)−1(N−M∗))=∑xηxu∗(x)−p≤0.

2.1givenF2F4F5F6F7F8F9step 1.1choosealgebra

If ξ∗ is D-optimal, the defining maximum property in [F2] gives gx(t)=log⁡det⁡Mt≤gx(0) for 0≤t<1, so its right derivative at 0 is nonpositive. By [F4], with its cofactor and adjugate support [F6], [F7], and [F8], the logarithm-chain rule [F9] gives gx′(0)=tr⁡((M∗)−1(f(x)f(x)T−M∗))=u∗(x)−p; the trace of the rank-one term is f(x)T(M∗)−1f(x) by the coordinate sum, and tr⁡(Ip)=p by [F5]. Thus u∗(x)≤p. Since x was arbitrary, the pointwise bound is necessary.

2.2F3step 1.2algebra

For 0<s<1, the concavity in step 1.2 gives g(s)≥(1−s)g(0)+sg(1), hence g(1)−g(0)≤(g(s)−g(0))/s. Let s↓0; the right derivative already computed in step 1.2 gives g(1)−g(0)≤g′(0)≤0. Thus log⁡det⁡N≤log⁡det⁡M∗. Since η was arbitrary among nonsingular designs, ξ∗ is D-optimal.

3.1F1F5step 1.2algebra∎

Finally, ∑xξx∗u∗(x)=tr⁡((M∗)−1∑xξx∗f(x)f(x)T)=tr⁡(Ip)=p by [F1] and [F5]. Each term is at most p by the bound assumed in step 1.2, so every term with ξx∗>0 equals p. This proves equality on the support and completes both directions.

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