-
Notifications
You must be signed in to change notification settings - Fork 122
/
SaveLauenorm.h
58 lines (48 loc) · 1.86 KB
/
SaveLauenorm.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
58
// Mantid Repository : https://github.com/mantidproject/mantid
//
// Copyright © 2018 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 "MantidDataObjects/PeaksWorkspace.h"
#include "MantidGeometry/Crystal/OrientedLattice.h"
namespace Mantid {
namespace Crystal {
/** Save a PeaksWorkspace to a lauenorm format
* http://www.ccp4.ac.uk/cvs/viewvc.cgi/laue/doc/lauenorm.ptx?diff_format=s&revision=1.1.1.1&view=markup
*
* @author Vickie Lynch, SNS
* @date 2014-07-24
*/
class MANTID_CRYSTAL_DLL SaveLauenorm : public API::Algorithm {
public:
/// Algorithm's name for identification
const std::string name() const override { return "SaveLauenorm"; };
/// Summary of algorithms purpose
const std::string summary() const override {
return "Save a PeaksWorkspace to a ASCII file for each detector.";
}
/// Algorithm's version for identification
int version() const override { return 1; };
/// Algorithm's category for identification
const std::string category() const override {
return "Crystal\\DataHandling;DataHandling\\Text";
}
private:
/// Initialise the properties
void init() override;
/// Run the algorithm
void exec() override;
DataObjects::PeaksWorkspace_sptr ws;
void sizeBanks(const std::string &bankName, int &nCols, int &nRows);
const std::vector<std::string> m_typeList{
"TRICLINIC", "MONOCLINIC", "ORTHORHOMBIC", "TETRAGONAL",
"HEXAGONAL", "RHOMBOHEDRAL", "CUBIC"};
const std::vector<std::string> m_centeringList{"P", "A", "B", "C",
"I", "F", "R"};
};
} // namespace Crystal
} // namespace Mantid