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altavir merged 71 commits from altavir/diff into commandertvis/diff 2022-07-16 09:58:44 +03:00
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kmath-tensors/src/commonMain/kotlin/space/kscience/kmath/tensors/core/DoubleTensorAlgebra.kt
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@ -10,6 +10,7 @@ package space.kscience.kmath.tensors.core
import space.kscience.kmath.misc.PerformancePitfall import space.kscience.kmath.misc.PerformancePitfall
import space.kscience.kmath.nd.MutableStructure2D import space.kscience.kmath.nd.MutableStructure2D
import space.kscience.kmath.nd.Structure2D
import space.kscience.kmath.nd.StructureND import space.kscience.kmath.nd.StructureND
import space.kscience.kmath.nd.as1D import space.kscience.kmath.nd.as1D
import space.kscience.kmath.nd.as2D import space.kscience.kmath.nd.as2D
@ -885,7 +886,7 @@ public open class DoubleTensorAlgebra :
return Triple(uTensor.transpose(), sTensor, vTensor.transpose()) return Triple(uTensor.transpose(), sTensor, vTensor.transpose())
} }
override fun StructureND<Double>.symEig(): Pair<DoubleTensor, DoubleTensor> = symEig(epsilon = 1e-15) override fun StructureND<Double>.symEig(): Pair<DoubleTensor, DoubleTensor> = symEigJacobi(epsilon = 1e-10)
/** /**
* Returns eigenvalues and eigenvectors of a real symmetric matrix input or a batch of real symmetric matrices, * Returns eigenvalues and eigenvectors of a real symmetric matrix input or a batch of real symmetric matrices,
@ -922,96 +923,99 @@ public open class DoubleTensorAlgebra :
return eig to v return eig to v
} }
// TODO public fun StructureND<Double>.symEigJacobi(epsilon: Double): Pair<DoubleTensor, DoubleTensor> {
// 1. Cyclic method
// 2. Sort eigenvalues
public fun StructureND<Double>.symEig(epsilon: Double): Pair<DoubleTensor, DoubleTensor> {
checkSymmetric(tensor, epsilon) checkSymmetric(tensor, epsilon)
val ii = tensor.minusIndex(-2)
val jj = tensor.minusIndex(-1)
val n = tensor.numElements
val size = this.dimension val size = this.dimension
val commonShape = this.shape.sliceArray(0 until size - 2) + intArrayOf(1, 1) val s = zeros(this.shape)
val eigenvalues = zeros(this.shape.sliceArray(0 until size - 1))
var d = this.copy() var eigenvalueStart = 0
var s = diagonalEmbedding(ones(this.shape.sliceArray(0 until size - 1))) var eigenvectorStart = 0
for (matrix in tensor.matrixSequence()) {
matrix.as2D().jacobiHelper(eigenvalues, s, eigenvalueStart, eigenvectorStart, epsilon)
eigenvalueStart += this.shape.last()
eigenvectorStart += this.shape.last() * this.shape.last()
}
// TODO sort eigenvalues
return eigenvalues to s
}
private fun MutableStructure2D<Double>.jacobiHelper(
eigenvalues: DoubleTensor,
eigenvectors: DoubleTensor,
eigenvalueStart: Int,
eigenvectorStart: Int,
epsilon: Double
) {
var d = this
var s = eye(this.shape[0])
// TODO implement cyclic method
do { do {
// 1. Find max element by abs value that is not on diagonal // 1. Find max element by abs value that is not on diagonal
val buffer = MutableBuffer.boxing(commonShape.reduce(Int::times)) { Triple(0.0, 0, 0) } var maxOffDiagonalElement = 0.0
val maxOffDiagonalElements = BufferedTensor(commonShape, buffer, 0) var maxElementIndex = Pair(0, 0)
for (offset in 0 until n) { for (i in 0 until this.rowNum) {
val multiIndex = d.linearStructure.index(offset) for (j in 0 until this.colNum) {
if (multiIndex[ii] != multiIndex[jj]) { if (i == j) continue
val value = d.mutableBuffer.array()[offset] if (abs(d[i, j]) > maxOffDiagonalElement) {
maxOffDiagonalElement = abs(d[i, j])
val commonIndex = multiIndex.sliceArray(0 until size - 2) + intArrayOf(0, 0) maxElementIndex = i to j
if (abs(value) > maxOffDiagonalElements[commonIndex].first) {
maxOffDiagonalElements[commonIndex] = Triple(abs(value), multiIndex[ii], multiIndex[jj])
} }
} }
} }
// 2. Evaluate "rotation" angle // 2. Evaluate "rotation" angle
val angles = zeros(commonShape) val dIJ = d[maxElementIndex.first, maxElementIndex.second]
for (offset in 0 until maxOffDiagonalElements.numElements) { val dII = d[maxElementIndex.first, maxElementIndex.first]
val (_, i, j) = maxOffDiagonalElements.mutableBuffer[offset] val dJJ = d[maxElementIndex.second, maxElementIndex.second]
val multiIndex = maxOffDiagonalElements.linearStructure.index(offset)
val dIJ = d.mutableBuffer[d.linearStructure.offset(multiIndex.also { it[ii] = i; it[jj] = j })] val angle = if (dII == dJJ) {
val dII = d.mutableBuffer[d.linearStructure.offset(multiIndex.also { it[ii] = i; it[jj] = i })] if (dIJ > 0) PI / 4 else -PI / 4
val dJJ = d.mutableBuffer[d.linearStructure.offset(multiIndex.also { it[ii] = j; it[jj] = j })] } else {
0.5 * atan(2 * dIJ / (dJJ - dII))
angles.mutableBuffer.array()[offset] = if (dII == dJJ) {
if (dIJ > 0) PI / 4 else -PI / 4
} else {
0.5 * atan(2 * dIJ / (dJJ - dII))
}
} }
// 3. Build rotation tensor `s1` // 3. Build rotation tensor `s1`
val s1 = diagonalEmbedding(ones(this.shape.sliceArray(0 until size - 1))) val s1 = eye(this.rowNum)
for (offset in 0 until n) { for (i in 0 until this.rowNum) {
val multiIndex = d.linearStructure.index(offset) for (j in 0 until this.colNum) {
s1.mutableBuffer.array()[i * this.rowNum + j] = when {
val commonIndex = multiIndex.sliceArray(0 until size - 2) + intArrayOf(0, 0) maxElementIndex.first == i && maxElementIndex.first == j -> cos(angle)
val (_, i, j) = maxOffDiagonalElements[commonIndex] maxElementIndex.second == i && maxElementIndex.second == j -> cos(angle)
val angleValue = angles[commonIndex] maxElementIndex.first == i && maxElementIndex.second == j -> sin(angle)
s1.mutableBuffer.array()[offset] = when { maxElementIndex.first == j && maxElementIndex.second == i -> -sin(angle)
multiIndex[ii] == i && multiIndex[jj] == i || multiIndex[ii] == j && multiIndex[jj] == j -> cos(angleValue) else -> s1.mutableBuffer.array()[i * this.rowNum + j]
multiIndex[ii] == i && multiIndex[jj] == j -> sin(angleValue) }
multiIndex[ii] == j && multiIndex[jj] == i -> -sin(angleValue)
else -> s1.mutableBuffer.array()[offset]
} }
} }
// 4. Evaluate new tensor // 4. Evaluate new tensor
d = (s1.transpose() dot d) dot s1 d = ((s1.transpose() dot d) dot s1).as2D()
s = s dot s1 s = s dot s1
if (d.isDiagonal(epsilon)) break if (d.isDiagonal(epsilon)) break
} while(true) } while(true)
val eigenvalues = zeros(d.shape.sliceArray(0 until size - 1)) // 5. Copy result
for (offset in 0 until n) { for (i in 0 until this.rowNum) {
val multiIndex = d.linearStructure.index(offset) for (j in 0 until this.colNum) {
if (multiIndex[ii] == multiIndex[jj]) { eigenvectors.mutableBuffer.array()[eigenvectorStart + i * this.rowNum + j] = s.mutableBuffer.array()[i * this.rowNum + j]
eigenvalues[multiIndex.sliceArray(0 until size - 1)] = d.mutableBuffer.array()[offset]
} }
} }
return eigenvalues to s for (i in 0 until this.rowNum) {
eigenvalues.mutableBuffer.array()[eigenvalueStart + i] = d[i, i]
}
} }
public fun StructureND<Double>.isDiagonal(epsilon: Double = 1e-9): Boolean { public fun Structure2D<Double>.isDiagonal(epsilon: Double = 1e-9): Boolean {
val ii = tensor.minusIndex(-2) for (i in 0 until this.rowNum) {
val jj = tensor.minusIndex(-1) for (j in 0 until this.colNum) {
if (i != j && abs(this[i, j]) > epsilon) {
for (offset in 0 until tensor.numElements) { return false
val multiIndex = tensor.linearStructure.index(offset) }
if (multiIndex[ii] != multiIndex[jj] && abs(tensor.mutableBuffer.array()[offset]) > epsilon) {
return false
} }
} }