-
Notifications
You must be signed in to change notification settings - Fork 122
/
SaveIsawUB.h
57 lines (49 loc) · 1.6 KB
/
SaveIsawUB.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
56
57
// Mantid Repository : https://github.com/mantidproject/mantid
//
// Copyright © 2009 ISIS Rutherford Appleton Laboratory UKRI,
// NScD Oak Ridge National Laboratory, European Spallation Source,
// Institut Laue - Langevin & CSNS, Institute of High Energy Physics, CAS
// SPDX - License - Identifier: GPL - 3.0 +
#pragma once
#include "MantidAPI/Algorithm.h"
#include "MantidCrystal/DllConfig.h"
#include "MantidGeometry/Crystal/OrientedLattice.h"
namespace Mantid {
namespace Crystal {
/** Algorithm to save a UB matrix and lattice parameters to an ISAW-style
* ASCII file.
*
* @author Ruth Mikkelson
* @date 2011-08-10
*
*
*
*/
class MANTID_CRYSTAL_DLL SaveIsawUB : public API::Algorithm {
public:
/// Algorithm's name for identification
const std::string name() const override { return "SaveIsawUB"; };
/// Summary of algorithms purpose
const std::string summary() const override {
return "Save a UB matrix and lattice parameters from a workspace to an "
"ISAW-style ASCII file.";
}
/// Algorithm's version for identification
int version() const override { return 1; };
const std::vector<std::string> seeAlso() const override {
return {"LoadIsawUB"};
}
/// Algorithm's category for identification
const std::string category() const override {
return "Crystal\\DataHandling;DataHandling\\Isaw";
}
private:
/// Initialise the properties
void init() override;
/// Run the algorithm
void exec() override;
// Calculates the error in the volume
double getErrorVolume(const Geometry::OrientedLattice &lattice);
};
} // namespace Crystal
} // namespace Mantid