libtrilinos-belos-dev 12.12.1-5 / usr / include / trilinos / BelosMultiVec.hpp

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//                 Belos: Block Linear Solvers Package
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#ifndef BELOS_MULTI_VEC_HPP
#define BELOS_MULTI_VEC_HPP

/// \file BelosMultiVec.hpp
/// \brief Interface for multivectors used by Belos' linear solvers.
///
/// We provide two options for letting Belos' linear solvers use
/// arbitrary multivector types.  One is via compile-time
/// polymorphism, by specializing Belos::MultiVecTraits.  The other is
/// via run-time polymorphism, by implementing Belos::MultiVec (the
/// interface defined in this header file).  Belos ultimately only
/// uses Belos::MultiVecTraits (it uses Belos::MultiVec via a
/// specialization of Belos::MultiVecTraits for Belos::MultiVec), so
/// the preferred way to tell Belos how to use your multivector class
/// is via a Belos::MultiVecTraits specialization.  However, some
/// users find a run-time polymorphic interface useful, so we provide
/// it as a service to them.

#include "BelosMultiVecTraits.hpp"
#include "BelosTypes.hpp"
#include "BelosConfigDefs.hpp"

namespace Belos {

/// \class MultiVec
/// \brief Interface for multivectors used by Belos' linear solvers.
/// \author Michael Heroux, Rich Lehoucq, and Heidi Thornquist
///
/// \tparam ScalarType The type of entries of the multivector.
///
/// Belos accesses multivectors through a traits interface called
/// MultiVecTraits.  If you want to use Belos with your own
/// multivector class MV, you may either specialize MultiVecTraits for
/// MV, or you may wrap MV in your own class that implements MultiVec.
/// Specializing MultiVecTraits works via compile-time polymorphism,
/// whereas implementing the MultiVec interface works via run-time
/// polymorphism.  You may pick whichever option you like.  However,
/// specializing MultiVecTraits is the preferred method.  This is
/// because Belos' linear solvers always use a specialization of
/// MultiVecTraits to access multivector operations.  They only use
/// MultiVec through a specialization of the MultiVecTraits traits
/// class, which is implemented below in this header file.
///
/// If you want your multivector class (or a wrapper thereof) to
/// implement the MultiVec interface, you should inherit from
/// MultiVec<ScalarType>, where ScalarType is the type of entries in
/// the multivector.  For example, a multivector with entries of type
/// double would inherit from MultiVec<double>.
template <class ScalarType>
class MultiVec {
public:
  //! @name Constructor/Destructor
  //@{ 
  //! Default constructor.
  MultiVec() {};
  
  //! Destructor (virtual for memory safety of derived classes).
  virtual ~MultiVec () {};
  
  //@}
  //! @name Creation methods for new multivectors
  //@{ 
  
  /// \brief Create a new MultiVec with \c numvecs columns.
  /// \return Pointer to the new multivector with uninitialized values.
  virtual MultiVec<ScalarType> * Clone ( const int numvecs ) const = 0;
  
  /// \brief Create a new MultiVec and copy contents of \c *this into it (deep copy).
  /// \return Pointer to the new multivector	
  virtual MultiVec<ScalarType> * CloneCopy () const = 0;
  
  /*! \brief Creates a new %Belos::MultiVec and copies the selected contents of \c *this 
    into the new multivector (deep copy).  The copied 
    vectors from \c *this are indicated by the \c index.size() indices in \c index.
    
    \return Pointer to the new multivector	
  */
  virtual MultiVec<ScalarType> * CloneCopy ( const std::vector<int>& index ) const = 0;
  
  /*! \brief Creates a new %Belos::MultiVec that shares the selected contents of \c *this.
    The index of the \c numvecs vectors copied from \c *this are indicated by the
    indices given in \c index.
    
    \return Pointer to the new multivector	
  */
  virtual MultiVec<ScalarType> * CloneViewNonConst ( const std::vector<int>& index ) = 0;
  
  /*! \brief Creates a new %Belos::MultiVec that shares the selected contents of \c *this.
    The index of the \c numvecs vectors copied from \c *this are indicated by the
    indices given in \c index.
    
    \return Pointer to the new multivector	
  */
  virtual const MultiVec<ScalarType> * CloneView ( const std::vector<int>& index ) const = 0;

  //@}
  //! @name Dimension information methods	
  //@{ 

  //! The number of rows in the multivector.
  virtual ptrdiff_t GetGlobalLength () const = 0;
 
  //! The number of vectors (i.e., columns) in the multivector.
  virtual int GetNumberVecs () const = 0;

  //@}
  //! @name Update methods
  //@{ 

  //! Update \c *this with \c alpha * \c A * \c B + \c beta * (\c *this).
  virtual void 
  MvTimesMatAddMv (const ScalarType alpha, 
		   const MultiVec<ScalarType>& A, 
		   const Teuchos::SerialDenseMatrix<int,ScalarType>& B, const ScalarType beta) = 0;
  
  //! Replace \c *this with \c alpha * \c A + \c beta * \c B.
  virtual void MvAddMv ( const ScalarType alpha, const MultiVec<ScalarType>& A, const ScalarType beta, const MultiVec<ScalarType>& B ) = 0;
  
  //! Scale each element of the vectors in \c *this with \c alpha.
  virtual void MvScale ( const ScalarType alpha ) = 0;
  
  //! Scale each element of the <tt>i</tt>-th vector in \c *this with <tt>alpha[i]</tt>.
  virtual void MvScale ( const std::vector<ScalarType>& alpha ) = 0;
  
  /*! \brief Compute a dense matrix \c B through the matrix-matrix multiply 
    \c alpha * \c A^T * (\c *this).
  */
  virtual void MvTransMv ( const ScalarType alpha, const MultiVec<ScalarType>& A, Teuchos::SerialDenseMatrix<int,ScalarType>& B) const = 0;

  /// \brief Compute the dot product of each column of *this with the corresponding column of A.
  ///
  /// Compute a vector \c b whose entries are the individual
  /// dot-products.  That is, <tt>b[i] = A[i]^H * (*this)[i]</tt>
  /// where <tt>A[i]</tt> is the i-th column of A.
  virtual void MvDot ( const MultiVec<ScalarType>& A, std::vector<ScalarType>& b ) const = 0;
  
  //@}
  //! @name Norm method
  //@{ 
  
  /// \brief Compute the norm of each vector in \c *this.  
  ///
  /// \param normvec [out] On output, normvec[i] holds the norm of the
  ///   \c i-th vector of \c *this.
  /// \param type [in] The type of norm to compute.  The 2-norm is the default.
  virtual void MvNorm ( std::vector<typename Teuchos::ScalarTraits<ScalarType>::magnitudeType>& normvec, NormType type = TwoNorm ) const = 0;
  
  //@}
  //! @name Initialization methods
  //@{ 

  /// \brief Copy the vectors in \c A to a set of vectors in \c *this.  
  ///
  /// The \c numvecs vectors in \c A are copied to a subset of vectors
  /// in \c *this indicated by the indices given in \c index.
  virtual void SetBlock ( const MultiVec<ScalarType>& A, const std::vector<int>& index ) = 0;

  //! Fill all the vectors in \c *this with random numbers.  
  virtual void MvRandom () = 0;
  
  //! Replace each element of the vectors in \c *this with \c alpha.
  virtual void MvInit ( const ScalarType alpha ) = 0;
  
  //@}
  //! @name Print method
  //@{ 

  //! Print \c *this multivector to the \c os output stream.
  virtual void MvPrint ( std::ostream& os ) const = 0;
  //@}

#ifdef HAVE_BELOS_TSQR
  //! @name TSQR-related methods
  //@{ 

  /// \brief Compute the QR factorization *this = QR, using TSQR.
  ///
  /// The *this multivector on input is the multivector A to factor.
  /// It is overwritten with garbage on output.
  ///
  /// \param Q [out] On input: a multivector with the same number of
  ///   rows and columns as A (the *this multivector).  Its contents
  ///   are overwritten on output with the (explicitly stored) Q
  ///   factor in the QR factorization of A.
  ///
  /// \param R [out] On output: the R factor in the QR factorization
  ///   of the (input) multivector A.
  ///
  /// \param forceNonnegativeDiagonal [in] If true, then (if
  ///   necessary) do extra work (modifying both the Q and R
  ///   factors) in order to force the R factor to have a
  ///   nonnegative diagonal.
  ///
  /// For syntax's sake, we provide a default implementation of this
  /// method that throws std::logic_error.  You should implement this
  /// method if you intend to use TsqrOrthoManager or
  /// TsqrMatOrthoManager with your subclass of MultiVec.
  virtual void 
  factorExplicit (MultiVec<ScalarType>& Q, 
		  Teuchos::SerialDenseMatrix<int, ScalarType>& R,
		  const bool forceNonnegativeDiagonal=false)
  {
    TEUCHOS_TEST_FOR_EXCEPTION(true, std::logic_error, "The Belos::MultiVec<" 
      << Teuchos::TypeNameTraits<ScalarType>::name() << "> subclass which you "
      "are using does not implement the TSQR-related method factorExplicit().");
  }

  /// \brief Use result of factorExplicit() to compute rank-revealing decomposition.
  ///
  /// When calling this method, the *this multivector should be the Q
  /// factor output of factorExplicit().  Using that Q factor and the
  /// R factor from factorExplicit(), compute the singular value
  /// decomposition (SVD) of R (\f$R = U \Sigma V^*\f$).  If R is full
  /// rank (with respect to the given relative tolerance tol), don't
  /// change Q (= *this) or R.  Otherwise, compute \f$Q := Q \cdot
  /// U\f$ and \f$R := \Sigma V^*\f$ in place (the latter may be no
  /// longer upper triangular).
  ///
  /// The *this multivector on input must be the explicit Q factor
  /// output of a previous call to factorExplicit().  On output: On
  /// output: If R is of full numerical rank with respect to the
  /// tolerance tol, Q is unmodified.  Otherwise, Q is updated so that
  /// the first rank columns of Q are a basis for the column space of
  /// A (the original matrix whose QR factorization was computed by
  /// factorExplicit()).  The remaining columns of Q are a basis for
  /// the null space of A.
  ///
  /// \param R [in/out] On input: N by N upper triangular matrix with
  ///   leading dimension LDR >= N.  On output: if input is full rank,
  ///   R is unchanged on output.  Otherwise, if \f$R = U \Sigma
  ///   V^*\f$ is the SVD of R, on output R is overwritten with
  ///   \f$\Sigma \cdot V^*\f$.  This is also an N by N matrix, but
  ///   may not necessarily be upper triangular.
  ///
  /// \param tol [in] Relative tolerance for computing the numerical
  ///   rank of the matrix R.
  ///
  /// For syntax's sake, we provide a default implementation of this
  /// method that throws std::logic_error.  You should implement this
  /// method if you intend to use TsqrOrthoManager or
  /// TsqrMatOrthoManager with your subclass of MultiVec.
  virtual int
  revealRank (Teuchos::SerialDenseMatrix<int, ScalarType>& R,
	      const typename Teuchos::ScalarTraits<ScalarType>::magnitudeType& tol)
  {
    TEUCHOS_TEST_FOR_EXCEPTION(true, std::logic_error, "The Belos::MultiVec<" 
      << Teuchos::TypeNameTraits<ScalarType>::name() << "> subclass which you "
      "are using does not implement the TSQR-related method revealRank().");
  }

  //@}
#endif // HAVE_BELOS_TSQR
};


namespace details {
/// \class MultiVecTsqrAdapter
/// \brief TSQR adapter for MultiVec.
///
/// TSQR (Tall Skinny QR factorization) is an orthogonalization
/// kernel that is as accurate as Householder QR, yet requires only
/// \f$2 \log P\f$ messages between $P$ MPI processes, independently
/// of the number of columns in the multivector.  
///
/// TSQR works independently of the particular multivector
/// implementation, and interfaces to the latter via an adapter
/// class.  Each multivector type MV needs its own adapter class.
/// The specialization of MultiVecTraits for MV refers to its
/// corresponding adapter class as its \c tsqr_adaptor_type [sic;
/// sorry about the lack of standard spelling of "adapter"] typedef.
///
/// This class is the TSQR adapter for MultiVec.  It merely calls 
/// MultiVec's corresponding methods for TSQR functionality.
template<class ScalarType>
class MultiVecTsqrAdapter {
public:
  typedef MultiVec<ScalarType> MV;
  typedef ScalarType scalar_type; 
  typedef int ordinal_type; // This doesn't matter either
  typedef int node_type; // Nor does this
  typedef Teuchos::SerialDenseMatrix<ordinal_type, scalar_type> dense_matrix_type;
  typedef typename Teuchos::ScalarTraits<scalar_type>::magnitudeType magnitude_type;
  
  //! Compute QR factorization A = QR, using TSQR.
  void
  factorExplicit (MV& A,
		  MV& Q,
		  dense_matrix_type& R,
		  const bool forceNonnegativeDiagonal=false)
  {
    A.factorExplicit (Q, R, forceNonnegativeDiagonal);
  }

  //! Compute rank-revealing decomposition using results of factorExplicit().
  int
  revealRank (MV& Q,
	      dense_matrix_type& R,
	      const magnitude_type& tol)
  {
    return Q.revealRank (R, tol);
  }

  void setParameterList (const Teuchos::RCP<Teuchos::ParameterList>& params) {
    (void) params;
  }
  
  Teuchos::RCP<const Teuchos::ParameterList> getValidParameters () const {
    return Teuchos::parameterList ();
  }
};
} // namespace details

  /// \brief Specialization of MultiVecTraits for Belos::MultiVec.
  ///
  /// Belos interfaces to every multivector implementation through a
  /// specialization of MultiVecTraits.  Thus, we provide a
  /// specialization of MultiVecTraits for the MultiVec run-time
  /// polymorphic interface above.
  ///
  /// \tparam ScalarType The type of entries in the multivector; the
  ///   template parameter of MultiVec.
  template<class ScalarType>
  class MultiVecTraits<ScalarType,MultiVec<ScalarType> > {
  public:
    //! @name Creation methods
    //@{ 

    /// \brief Create a new empty \c MultiVec containing \c numvecs columns.
    /// \return Reference-counted pointer to the new \c MultiVec.
    static Teuchos::RCP<MultiVec<ScalarType> > 
    Clone (const MultiVec<ScalarType>& mv, const int numvecs) {
      return Teuchos::rcp (const_cast<MultiVec<ScalarType>&> (mv).Clone (numvecs)); 
    }
    ///
    static Teuchos::RCP<MultiVec<ScalarType> > CloneCopy( const MultiVec<ScalarType>& mv )
    { return Teuchos::rcp( const_cast<MultiVec<ScalarType>&>(mv).CloneCopy() ); }
    ///
    static Teuchos::RCP<MultiVec<ScalarType> > CloneCopy( const MultiVec<ScalarType>& mv, const std::vector<int>& index )
    { return Teuchos::rcp( const_cast<MultiVec<ScalarType>&>(mv).CloneCopy(index) ); }
    ///
    static Teuchos::RCP<MultiVec<ScalarType> > 
    CloneViewNonConst (MultiVec<ScalarType>& mv, const std::vector<int>& index)
    { 
      return Teuchos::rcp( mv.CloneViewNonConst(index) ); 
    }

    static Teuchos::RCP<MultiVec<ScalarType> > 
    CloneViewNonConst (MultiVec<ScalarType>& mv, const Teuchos::Range1D& index)
    { 
      // mfh 02 Mar 2013: For now, we'll just use the above index
      // vector version of CloneViewNonConst to implement this, since
      // that doesn't require adding to the MultiVec interface.
      std::vector<int> indVec (index.size ());
      for (int k = 0; k < index.size (); ++k) {
	indVec[k] = k;
      }
      return CloneViewNonConst (mv, indVec);
    }

    ///
    static Teuchos::RCP<const MultiVec<ScalarType> > 
    CloneView (const MultiVec<ScalarType>& mv, const std::vector<int>& index) {
      return Teuchos::rcp( const_cast<MultiVec<ScalarType>&>(mv).CloneView(index) ); 
    }

    static Teuchos::RCP<const MultiVec<ScalarType> > 
    CloneView (const MultiVec<ScalarType>& mv, const Teuchos::Range1D& index)
    { 
      // mfh 02 Mar 2013: For now, we'll just use the above index
      // vector version of CloneView to implement this, since that
      // doesn't require adding to the MultiVec interface.
      std::vector<int> indVec (index.size ());
      for (int k = 0; k < index.size (); ++k) {
	indVec[k] = k;
      }
      return CloneView (mv, indVec);
    }

    ///
    static ptrdiff_t GetGlobalLength( const MultiVec<ScalarType>& mv )
    { return mv.GetGlobalLength(); }
    ///
    static int GetNumberVecs( const MultiVec<ScalarType>& mv )
    { return mv.GetNumberVecs(); }
    ///
    static void MvTimesMatAddMv( ScalarType alpha, const MultiVec<ScalarType>& A, 
				 const Teuchos::SerialDenseMatrix<int,ScalarType>& B, 
				 ScalarType beta, MultiVec<ScalarType>& mv )
    { mv.MvTimesMatAddMv(alpha, A, B, beta); }
    ///
    static void MvAddMv( ScalarType alpha, const MultiVec<ScalarType>& A, ScalarType beta, const MultiVec<ScalarType>& B, MultiVec<ScalarType>& mv )
    { mv.MvAddMv(alpha, A, beta, B); }
    ///
    static void MvScale ( MultiVec<ScalarType>& mv, const ScalarType alpha )
    { mv.MvScale( alpha ); } 

    static void MvScale ( MultiVec<ScalarType>& mv, const std::vector<ScalarType>& alpha )
    { mv.MvScale(alpha); }
    ///
    static void MvTransMv( const ScalarType alpha, const MultiVec<ScalarType>& A, const MultiVec<ScalarType>& mv, Teuchos::SerialDenseMatrix<int,ScalarType>& B )
    { mv.MvTransMv(alpha, A, B); }
    ///
    static void MvDot( const MultiVec<ScalarType>& mv, const MultiVec<ScalarType>& A, std::vector<ScalarType>& b )
    { mv.MvDot( A, b ); }
    ///
    static void MvNorm( const MultiVec<ScalarType>& mv, std::vector<typename Teuchos::ScalarTraits<ScalarType>::magnitudeType>& normvec, NormType type = TwoNorm )
    { mv.MvNorm(normvec,type); }
    ///
    static void SetBlock( const MultiVec<ScalarType>& A, const std::vector<int>& index, MultiVec<ScalarType>& mv )
    { mv.SetBlock(A, index); }

    static void 
    Assign (const MultiVec<ScalarType>& A, 
	    MultiVec<ScalarType>& mv) 
    {
      // mfh 02 Mar 2013: For now, we'll just use SetBlock to implement this,
      // since that doesn't require adding to the MultiVec interface.
      const int numVecsRhs = GetNumberVecs (A);
      const int numVecsLhs = GetNumberVecs (mv);

      TEUCHOS_TEST_FOR_EXCEPTION(
        numVecsLhs != numVecsRhs, std::invalid_argument, 
	"Belos::MultiVecTraits::Assign: Input multivector A has " << numVecsRhs
	<< " columns, which differs from the number of columns " << numVecsLhs
	<< " in the output multivector mv.");

      // mfh 02 Mar 2013: It's pretty silly to build this each time.
      // However, at least that makes the code correct.
      std::vector<int> index (numVecsRhs);
      for (int k = 0; k < numVecsRhs; ++k) {
	index[k] = k;
      }
      SetBlock (A, index, mv);
    }

    ///
    static void MvRandom( MultiVec<ScalarType>& mv )
    { mv.MvRandom(); }
    ///
    static void MvInit( MultiVec<ScalarType>& mv, ScalarType alpha = Teuchos::ScalarTraits<ScalarType>::zero() )
    { mv.MvInit(alpha); }
    ///
    static void MvPrint( const MultiVec<ScalarType>& mv, std::ostream& os )
    { mv.MvPrint(os); }

#ifdef HAVE_BELOS_TSQR
    /// \typedef tsqr_adaptor_type
    /// \brief TSQR adapter for MultiVec.
    ///
    /// Our TSQR adapter for MultiVec calls MultiVec's virtual
    /// methods.  If you want to use TSQR with your MultiVec subclass,
    /// you must implement these methods yourself, as the default
    /// implementations throw std::logic_error.
    typedef details::MultiVecTsqrAdapter<ScalarType> tsqr_adaptor_type;
#endif // HAVE_BELOS_TSQR
  };


} // namespace Belos

#endif

// end of file BelosMultiVec.hpp