Searched defs:matrix_sqrt_proot (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | iterate_matrix.F | 1336 SUBROUTINE matrix_sqrt_proot(matrix_sqrt, matrix_sqrt_inv, matrix, threshold, order, & subroutine
1345 CHARACTER(LEN=*), PARAMETER :: routineN = 'matrix_sqrt_proot', & argument
1346 routineP = moduleN//':'//routineN
1348 INTEGER :: choose, handle, i, ii, j, unit_nr
1349 INTEGER(KIND=int_8) :: f, flop1, flop2, flop3, flop4, flop5
1350 LOGICAL :: arnoldi_converged, test, tsym
1351 REAL(KIND=dp) :: conv, frob_matrix, frob_matrix_base, &
1352 max_ev, min_ev, occ_matrix, scaling, &
1353 t1, t2
1354 TYPE(cp_logger_type), POINTER :: logger
[all …]
|
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | iterate_matrix.F | 1590 SUBROUTINE matrix_sqrt_proot(matrix_sqrt, matrix_sqrt_inv, matrix, threshold, order, & subroutine
1599 CHARACTER(LEN=*), PARAMETER :: routineN = 'matrix_sqrt_proot', & argument
1600 routineP = moduleN//':'//routineN
1602 INTEGER :: choose, handle, i, ii, j, unit_nr
1603 INTEGER(KIND=int_8) :: f, flop1, flop2, flop3, flop4, flop5
1604 LOGICAL :: arnoldi_converged, test, tsym
1605 REAL(KIND=dp) :: conv, frob_matrix, frob_matrix_base, &
1606 max_ev, min_ev, occ_matrix, scaling, &
1607 t1, t2
1608 TYPE(cp_logger_type), POINTER :: logger
[all …]
|