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54 lines
1.6 KiB
C++
54 lines
1.6 KiB
C++
// main.cpp
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#include "SM_MaponiA3.hpp"
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#include "SM_Helpers.hpp"
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int main() {
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unsigned int M = 3; // Dimension of the Slater-matrix
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unsigned int i, j; // Indices for iterators
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// Declare, allocate all vectors and matrices and fill them with zeros
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unsigned int *Ar_index = new unsigned int[M];
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double *A = new double[M*M]; // The matrix to be inverted
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double *A0 = new double[M*M]; // A diagonal matrix with the digonal elements of A
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double *Ar = new double[M*M]; // The update matrix
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double *A0_inv = new double[M*M]; // The inverse
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// Fill with zeros
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for (i = 0; i < M; i++) {
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for (j = 0; j < M; j++) {
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A0[i*M+j] = 0;
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Ar[i*M+j] = 0;
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A0_inv[i*M+j] = 0;
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}
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}
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// Initialize A with M=3 and fill acc. to Eq. (17) from paper
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A[0] = 1; A[3] = 1; A[6] = -1;
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A[1] = 1; A[4] = 1; A[7] = 0;
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A[2] = -1; A[5] = 0; A[8] = -1;
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showMatrix(A, M, "A");
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// Initialize the diagonal matrix A0,
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// the inverse of A0_inv of diagonal matrix A0_inv
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// and the update matrix Ar
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for (i = 0; i < M; i++) {
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A0[i*M + i] = A[i*M + i];
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A0_inv[i*M + i] = 1.0/A[i*M + i];
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Ar_index[i] = i+1; // ! First column needs to start with 1 !
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for (j = 0; j < M; j++) {
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Ar[i*M + j] = A[i*M + j] - A0[i*M + j];
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}
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}
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// Define pointers dim and n_updates to use in Sherman-Morrison(...) function call
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MaponiA3(A0_inv, M, M, Ar, Ar_index);
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showMatrix(A0_inv, M, "A0_inv");
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// Deallocate all vectors and matrices
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delete [] A, A0, A0_inv, Ar, Ar_index;
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return 0;
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}
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