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| module | qs_ot_eigensolver |
| | an eigen-space solver for the generalised symmetric eigenvalue problem for sparse matrices, needing only multiplications
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| subroutine, public | qs_ot_eigensolver::ot_eigensolver (matrix_h, matrix_s, matrix_orthogonal_space_fm, matrix_c_fm, preconditioner, eps_gradient, iter_max, size_ortho_space, silent, ot_settings) |
| | ...
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| subroutine, public | qs_ot_eigensolver::ot_eigensolver_complex (matrix_h, matrix_h_im, matrix_s, matrix_s_im, matrix_c_cfm, preconditioner, eps_gradient, iter_max, eigenvalues, silent, ot_settings, matrix_t, matrix_t_im, mo_set) |
| | solve a fixed complex Hermitian generalized eigenproblem by OT
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