-
Notifications
You must be signed in to change notification settings - Fork 122
/
CalculatePeaksHKL.h
55 lines (42 loc) · 1.75 KB
/
CalculatePeaksHKL.h
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
#ifndef MANTID_CRYSTAL_CALCULATEPEAKSHKL_H_
#define MANTID_CRYSTAL_CALCULATEPEAKSHKL_H_
#include "MantidKernel/System.h"
#include "MantidAPI/Algorithm.h"
namespace Mantid {
namespace Crystal {
/** CalculatePeaksHKL : Calculate the HKL value for each peak without any
rounding or optimization
* of the UB Matrix.
Copyright © 2013 ISIS Rutherford Appleton Laboratory, NScD Oak Ridge
National Laboratory & European Spallation Source
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 CalculatePeaksHKL : public API::Algorithm {
public:
const std::string name() const override;
/// Summary of algorithms purpose
const std::string summary() const override {
return "Calculates Miller indices for each peak. No rounding or UB "
"optimization.";
}
int version() const override;
const std::string category() const override;
private:
void init() override;
void exec() override;
};
} // namespace Crystal
} // namespace Mantid
#endif /* MANTID_CRYSTAL_CALCULATEPEAKSHKL_H_ */