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FindUBUsingFFT.h
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FindUBUsingFFT.h
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#ifndef MANTID_CRYSTAL_FIND_UB_USING_FFT_H_
#define MANTID_CRYSTAL_FIND_UB_USING_FFT_H_
#include "MantidAPI/Algorithm.h"
namespace Mantid {
namespace Crystal {
/** FindUBUsingFFT : Algorithm to calculate a UB matrix using fast Fourier
transforms given a list of peaks and bounds on the lattice parameters.
@author Dennis Mikkelson(adapted from Andrei Savici's CalculateUMatrix)
@date 2011-08-17
Copyright © 2011 ISIS Rutherford Appleton Laboratory &
NScD Oak Ridge National Laboratory
This file is part of Mantid.
Mantid is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 3 of the License, or
(at your option) any later version.
Mantid is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License
along with this program. If not, see <http://www.gnu.org/licenses/>.
File change history is stored at:
<https://github.com/mantidproject/mantid>
Code Documentation is available at: <http://doxygen.mantidproject.org>
*/
class DLLExport FindUBUsingFFT : public API::Algorithm {
public:
/// Algorithm's name for identification
const std::string name() const override;
/// Algorithm's version for identification
int version() const override;
/// Algorithm's category for identification
const std::string category() const override;
/// Summary of algorithms purpose
const std::string summary() const override {
return "Calculate the UB matrix from a peaks workspace, given min(a,b,c) "
"and max(a,b,c).";
}
private:
/// Initialise the properties
void init() override;
/// Run the algorithm
void exec() override;
};
} // namespace Crystal
} // namespace Mantid
#endif /* MANTID_CRYSTAL_FIND_UB_USING_FFT_H_ */