1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265
|
/*
* This example demonstrates the use of ISO_C_BINDING to call parpack
* (portability). IMPORTANT: MPI communicators MUST be passed from C to Fortran
* using MPI_Comm_c2f.
*
* Just use arpack as you would have normally done but use [ae]upd instead
* of *[ae]upd_. The main advantage is that checks of the arguments are
* performed at compile time. Note: to debug parpack, call debug_c.
* This test program solves for the 9 eigenvalues of
* A*x = lambda*x where A is the diagonal matrix
* with entries 1000, 999, ... , 2, 1 on the diagonal.
*/
#include <cmath>
#include <iostream>
#include <vector>
#include "parpack.hpp"
#include "debug_c.hpp" // debug parpack.
#include "stat_c.hpp" // arpack statistics.
template <typename Real>
void diagonal_matrix_vector_product(int start, int nloc, const Real* x, Real* y) {
for (int i = 0; i < nloc; ++i) {
y[i] = static_cast<Real>(start + i + 1) * x[i];
}
}
template <typename Real>
void real_symmetric_runner(double const& tol_check, arpack::which const& ritz_option) {
const a_int N = 1000;
const a_int nev = 9;
const a_int ncv = 2 * nev + 1;
const a_int ldv = N;
const a_int ldz = N;
const a_int lworkl = ncv * (ncv + 8);
const a_int rvec = 1; // need eigenvectors
const Real tol = 0.000001; // small tol => more stable checks after EV computation.
const Real sigma = 0.0f; // not referenced in this mode
std::vector<Real> resid(N);
std::vector<Real> V(ldv * ncv);
std::vector<Real> z(ldz * nev);
std::vector<Real> d(nev);
std::vector<Real> workd(3 * N);
std::vector<Real> workl(lworkl);
std::vector<a_int> select(ncv); // since HOWMNY = 'A', only used as workspace here
a_int iparam[11], ipntr[11];
iparam[0] = 1; // ishift
iparam[2] = 10 * N; // on input: maxit; on output: actual iteration
iparam[3] = 1; // NB, only 1 allowed
iparam[6] = 1; // mode
MPI_Fint MCW = MPI_Comm_c2f(MPI_COMM_WORLD);
/// Split problem across each process/////////////////////
int rank, nprocs;
MPI_Comm_rank(MPI_COMM_WORLD, &rank);
MPI_Comm_size(MPI_COMM_WORLD, &nprocs);
a_int N_local = N / nprocs;
if (rank < N % nprocs) // spread the remaining on each process
N_local = N_local + 1;
std::cout<< "rank: " << rank << ", size :" << N_local << "\n";
int start = rank*(N / nprocs) + std::min(rank, N % nprocs);
std::cout<< "rank: " <<rank<< ", start:" << start<<"\n";
//////////////////////////////////////////////////////////
a_int info = 0, ido = 0;
do {
arpack::saupd(MCW, ido, arpack::bmat::identity, N_local,
ritz_option, nev, tol, resid.data(), ncv,
V.data(), ldv, iparam, ipntr, workd.data(),
workl.data(), lworkl, info);
diagonal_matrix_vector_product(start, N_local, &(workd[ipntr[0] - 1]), &(workd[ipntr[1] - 1]));
} while (ido == 1 || ido == -1);
// check info and number of ev found by arpack.
if (info < 0 || iparam[4] < nev) { /*arpack may succeed to compute more EV than expected*/
std::cout << "ERROR in saupd: iparam[4] " << iparam[4] << ", nev " << nev
<< ", info " << info << std::endl;
throw std::domain_error("Error inside ARPACK routines");
}
arpack::seupd(MCW, rvec, arpack::howmny::ritz_vectors, select.data(),
d.data(), z.data(), ldz, sigma, arpack::bmat::identity, N_local,
ritz_option, nev, tol, resid.data(), ncv,
V.data(), ldv, iparam, ipntr, workd.data(),
workl.data(), lworkl, info);
if (info < 0) throw std::runtime_error("Error in seupd, info " + std::to_string(info));
for (int i = 0; i < nev; ++i) {
Real val = d[i];
Real ref = (N - (nev - 1) + i);
Real eps = std::fabs(val - ref);
std::cout << "rank " << rank << " : " << val << " - " << ref << " - " << eps << std::endl;
/*eigen value order: smallest -> biggest*/
if (eps > tol_check) throw std::domain_error("Correct eigenvalues not computed");
}
std::cout << "------" << std::endl;
}
template <typename Real>
void diagonal_matrix_vector_product(int start, int N_local, const std::complex<Real>* x, std::complex<Real>* y) {
for (int i = 0; i < N_local; ++i) {
// Use complex matrix (i, -i) instead of (i, i): this way "largest_magnitude"
// and "largest_imaginary" options produce different results that can be checked.
y[i] = x[i] * std::complex<Real>{Real(start + i + 1), -Real(start + i + 1)};
}
}
template <typename Real>
void complex_nonsymmetric_runner(double const& tol_check, arpack::which const& ritz_option) {
const a_int N = 1000;
const a_int nev = 9;
const a_int ncv = 2 * nev + 1;
const a_int ldv = N;
const a_int ldz = N;
const a_int lworkl = ncv * (3 * ncv + 5);
const a_int rvec = 0; // eigenvectors omitted
const Real tol = 0.000001; // small tol => more stable checks after EV computation.
const std::complex<Real> sigma(0.0f, 0.0f); // not referenced in this mode
std::vector<std::complex<Real>> resid(N);
std::vector<std::complex<Real>> V(ldv * ncv);
std::vector<std::complex<Real>> z(ldz * nev);
std::vector<std::complex<Real>> d(nev);
std::vector<std::complex<Real>> workd(3 * N);
std::vector<std::complex<Real>> workl(lworkl);
std::vector<std::complex<Real>> workev(2 * ncv);
std::vector<Real> rwork(ncv);
std::vector<a_int> select(ncv); // since HOWMNY = 'A', only used as workspace here
a_int iparam[11], ipntr[14];
iparam[0] = 1; // ishift
iparam[2] = 10 * N; // on input: maxit; on output: actual iteration
iparam[3] = 1; // NB, only 1 allowed
iparam[6] = 1; // mode
MPI_Fint MCW = MPI_Comm_c2f(MPI_COMM_WORLD);
/// Split problem across each process/////////////////////
int rank, nprocs;
MPI_Comm_rank(MPI_COMM_WORLD, &rank);
MPI_Comm_size(MPI_COMM_WORLD, &nprocs);
a_int N_local = N / nprocs;
if (rank < N % nprocs) // spread the remaining on each process
N_local = N_local + 1;
std::cout<< "rank: "<<rank<<", size :"<<N_local<<"\n";
int start = rank * (N / nprocs) + std::min(rank, N % nprocs);
std::cout<< "rank: " << rank << ", start:" << start << "\n";
//////////////////////////////////////////////////////////
a_int info = 0, ido = 0;
do {
arpack::naupd(MCW, ido, arpack::bmat::identity, N_local,
ritz_option, nev, tol, resid.data(), ncv,
V.data(), ldv, iparam, ipntr, workd.data(),
workl.data(), lworkl, rwork.data(), info);
diagonal_matrix_vector_product(start, N_local, &(workd[ipntr[0] - 1]), &(workd[ipntr[1] - 1]));
} while (ido == 1 || ido == -1);
// check info and number of ev found by arpack
if (info < 0 || iparam[4] < nev) { /*arpack may succeed to compute more EV than expected*/
std::cout << "ERROR in naupd: iparam[4] " << iparam[4] << ", nev " << nev
<< ", info " << info << std::endl;
throw std::domain_error("Error inside ARPACK routines");
}
arpack::neupd(MCW, rvec, arpack::howmny::ritz_vectors, select.data(),
d.data(), z.data(), ldz, sigma, workev.data(),
arpack::bmat::identity, N_local, ritz_option,
nev, tol, resid.data(), ncv, V.data(), ldv, iparam,
ipntr, workd.data(), workl.data(), lworkl, rwork.data(), info);
if (info < 0) throw std::runtime_error("Error in neupd, info " + std::to_string(info));
if (ritz_option == arpack::which::largest_magnitude) {
for (int i = 0; i < nev; ++i) {
Real rval = std::real(d[i]);
Real rref = static_cast<Real>(N - (nev - 1) + i);
Real reps = std::fabs(rval - rref);
Real ival = std::imag(d[i]);
Real iref = -static_cast<Real>(N - (nev - 1) + i);
Real ieps = std::fabs(ival - iref);
std::cout << rval << " " << ival << " - " << rref << " " << iref << " - " << reps << " " << ieps << std::endl;
if (reps > tol_check || ieps > tol_check) throw std::domain_error("Correct eigenvalues not computed");
}
} else if (ritz_option == arpack::which::largest_imaginary) {
for (int i = 0; i < nev; ++i) {
Real rval = std::real(d[i]);
Real rref = static_cast<Real>(nev - i);
Real reps = std::fabs(rval - rref);
Real ival = std::imag(d[i]);
Real iref = -static_cast<Real>(nev - i);
Real ieps = std::fabs(ival - iref);
std::cout << rval << " " << ival << " - " << rref << " " << iref << " - " << reps << " " << ieps << std::endl;
if (reps > tol_check || ieps > tol_check) throw std::domain_error("Correct eigenvalues not computed");
}
} else {
throw std::domain_error("The input Ritz option is not allowed in this test file.");
}
std::cout << "------" << std::endl;
}
int main() {
MPI_Init(NULL, NULL);
sstats_c();
try {
// parpack without debug
real_symmetric_runner<float>(1., arpack::which::largest_magnitude);
real_symmetric_runner<float>(1., arpack::which::largest_algebraic);
real_symmetric_runner<double>(1.e-05, arpack::which::largest_magnitude);
real_symmetric_runner<double>(1.e-05, arpack::which::largest_algebraic);
} catch (std::domain_error& e) {
std::cout << e.what() << std::endl;
MPI_Abort(MPI_COMM_WORLD, 1);
}
MPI_Barrier(MPI_COMM_WORLD);
a_int nopx_c, nbx_c, nrorth_c, nitref_c, nrstrt_c;
float tsaupd_c, tsaup2_c, tsaitr_c, tseigt_c, tsgets_c, tsapps_c, tsconv_c;
float tnaupd_c, tnaup2_c, tnaitr_c, tneigt_c, tngets_c, tnapps_c, tnconv_c;
float tcaupd_c, tcaup2_c, tcaitr_c, tceigt_c, tcgets_c, tcapps_c, tcconv_c;
float tmvopx_c, tmvbx_c, tgetv0_c, titref_c, trvec_c;
stat_c(nopx_c, nbx_c, nrorth_c, nitref_c, nrstrt_c, tsaupd_c, tsaup2_c,
tsaitr_c, tseigt_c, tsgets_c, tsapps_c, tsconv_c, tnaupd_c, tnaup2_c,
tnaitr_c, tneigt_c, tngets_c, tnapps_c, tnconv_c, tcaupd_c, tcaup2_c,
tcaitr_c, tceigt_c, tcgets_c, tcapps_c, tcconv_c, tmvopx_c, tmvbx_c,
tgetv0_c, titref_c, trvec_c);
std::cout << "Timers : nopx " << nopx_c << ", tmvopx " << tmvopx_c;
std::cout << " - nbx " << nbx_c << ", tmvbx " << tmvbx_c << std::endl;
int rank = 0;
MPI_Comm_rank(MPI_COMM_WORLD, &rank);
if (rank == 0) std::cout << "------" << std::endl;
// set debug flags.
debug_c(6, -6, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1,
1);
try {
complex_nonsymmetric_runner<float>(1., arpack::which::largest_magnitude);
complex_nonsymmetric_runner<float>(1., arpack::which::largest_imaginary);
complex_nonsymmetric_runner<double>(1.e-05, arpack::which::largest_magnitude);
complex_nonsymmetric_runner<double>(1.e-05, arpack::which::largest_imaginary);
} catch (std::domain_error& e) {
std::cout << e.what() << '\n';
MPI_Abort(MPI_COMM_WORLD, 1);
}
MPI_Barrier(MPI_COMM_WORLD);
MPI_Finalize();
return 0;
}
|