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Zhou, Wenduo authoredAdd POWGEN SystemTestData
Zhou, Wenduo authoredAdd POWGEN SystemTestData
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SNSPowderRedux.py 9.33 KiB
#pylint: disable=no-init,invalid-name,attribute-defined-outside-init
import stresstesting
from mantid.simpleapi import *
from mantid.api import FileFinder
import os
def getSaveDir():
"""determine where to save - the current working directory"""
import os
return os.path.abspath(os.path.curdir)
def do_cleanup():
Files = ["PG3_9829.gsa",
"PG3_9829.py",
"PG3_9830.gsa",
"PG3_9830.py",
"PG3_4844-1.dat",
"PG3_4844.getn",
"PG3_4844.gsa",
"PG3_4844.py",
"PG3_4866.gsa"]
for file in Files:
absfile = FileFinder.getFullPath(file)
if os.path.exists(absfile):
os.remove(absfile)
return True
class PG3Analysis(stresstesting.MantidStressTest):
ref_file = 'PG3_4844_reference.gsa'
cal_file = "PG3_FERNS_d4832_2011_08_24.cal"
char_file = "PG3_characterization_2011_08_31-HR.txt"
def cleanup(self):
do_cleanup()
return True
def requiredFiles(self):
files = [self.ref_file, self.cal_file, self.char_file]
files.append("PG3_4844_event.nxs") # /SNS/PG3/IPTS-2767/0/
files.append("PG3_4866_event.nxs") # /SNS/PG3/IPTS-2767/0/
files.append("PG3_5226_event.nxs") # /SNS/PG3/IPTS-2767/0/
return files
def runTest(self):
savedir = getSaveDir()
# run the actual code
SNSPowderReduction(Instrument="PG3", RunNumber=4844, Extension="_event.nxs",
PreserveEvents=True,
CalibrationFile=self.cal_file,
CharacterizationRunsFile=self.char_file,
LowResRef=15000, RemovePromptPulseWidth=50,
Binning=-0.0004, BinInDspace=True, FilterBadPulses=95,
SaveAs="gsas and fullprof and pdfgetn", OutputDirectory=savedir,
FinalDataUnits="dSpacing")
# load output gsas file and the golden one
LoadGSS(Filename="PG3_4844.gsa", OutputWorkspace="PG3_4844")
LoadGSS(Filename=self.ref_file, OutputWorkspace="PG3_4844_golden")
def validateMethod(self):
self.tolerance = 1.0e-2
return "ValidateWorkspaceToWorkspace"
def validate(self):
self.tolerance = 1.0e-2
return ('PG3_4844','PG3_4844_golden')
class PG3StripPeaks(stresstesting.MantidStressTest):
ref_file = 'PG3_4866_reference.gsa'
cal_file = "PG3_FERNS_d4832_2011_08_24.cal"
def cleanup(self):
do_cleanup()
return True
def requiredFiles(self):
files = [self.ref_file, self.cal_file]
files.append("PG3_4866_event.nxs") # vanadium
return files
def runTest(self):
# determine where to save
import os
savedir = os.path.abspath(os.path.curdir)
LoadEventNexus(Filename="PG3_4866_event.nxs",
OutputWorkspace="PG3_4866",
Precount=True)
FilterBadPulses(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866")
RemovePromptPulse(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Width=50)
CompressEvents(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Tolerance=0.01)
SortEvents(InputWorkspace="PG3_4866")
CropWorkspace(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
XMax=16666.669999999998)
LoadCalFile(InputWorkspace="PG3_4866",
CalFilename=self.cal_file,
WorkspaceName="PG3")
MaskDetectors(Workspace="PG3_4866",
MaskedWorkspace="PG3_mask")
AlignDetectors(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
OffsetsWorkspace="PG3_offsets")
ConvertUnits(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Target="TOF")
UnwrapSNS(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
LRef=62)
RemoveLowResTOF(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
ReferenceDIFC=1500)
ConvertUnits(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Target="dSpacing")
Rebin(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Params=(0.1,-0.0004,2.2))
SortEvents(InputWorkspace="PG3_4866")
DiffractionFocussing(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
GroupingWorkspace="PG3_group")
EditInstrumentGeometry(Workspace="PG3_4866",
PrimaryFlightPath=60,
SpectrumIDs=[1],
L2=[3.2208],
Polar=[90.8074],
Azimuthal=[0])
ConvertUnits(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Target="TOF")
Rebin(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Params=[-0.0004])
ConvertUnits(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Target="dSpacing")
StripVanadiumPeaks(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
PeakPositionTolerance=0.05,
FWHM=8,
BackgroundType="Quadratic")
ConvertUnits(InputWorkspace="PG3_4866",
OutputWorkspace="PG3_4866",
Target="TOF")
SaveGSS(InputWorkspace="PG3_4866",
Filename=os.path.join(savedir, "PG3_4866.gsa"),
SplitFiles=False,
Append=False,
Format="SLOG",
MultiplyByBinWidth=False,
ExtendedHeader=True)
# load output gsas file and the golden one
LoadGSS(Filename="PG3_4866.gsa", OutputWorkspace="PG3_4866")
LoadGSS(Filename=self.ref_file, OutputWorkspace="PG3_4866_golden")
def validateMethod(self):
self.tolerance = 1.0e-2
return "ValidateWorkspaceToWorkspace"
def validate(self):
self.tolerance = 1.0e-2
return ('PG3_4866','PG3_4866_golden')
class SeriesAndConjoinFilesTest(stresstesting.MantidStressTest):
cal_file = "PG3_FERNS_d4832_2011_08_24.cal"
char_file = "PG3_characterization_2012_02_23-HR-ILL.txt"
ref_files = ['PG3_9829_reference.gsa', 'PG3_9830_reference.gsa']
data_files = ['PG3_9829_event.nxs', 'PG3_9830_event.nxs']
def cleanup(self):
do_cleanup()
return True
def requiredMemoryMB(self):
"""Requires 3Gb"""
return 3000
def requiredFiles(self):
files = [self.cal_file, self.char_file]
files.extend(self.ref_files)
files.extend(self.data_files)
return files
def runTest(self):
savedir = getSaveDir()
# reduce a sum of runs - and drop it
SNSPowderReduction(Instrument="PG3", RunNumber=[9829,9830], Extension="_event.nxs",
Sum=True, # This is the difference with the next call
PreserveEvents=True, VanadiumNumber=-1,
CalibrationFile=self.cal_file,
CharacterizationRunsFile=self.char_file,
LowResRef=15000, RemovePromptPulseWidth=50,
Binning=-0.0004, BinInDspace=True, FilterBadPulses=True,
SaveAs="gsas", OutputDirectory=savedir,
FinalDataUnits="dSpacing")
# reduce a series of runs
SNSPowderReduction(Instrument="PG3", RunNumber=[9829,9830], Extension="_event.nxs",
PreserveEvents=True, VanadiumNumber=-1,
CalibrationFile=self.cal_file,
CharacterizationRunsFile=self.char_file,
LowResRef=15000, RemovePromptPulseWidth=50,
Binning=-0.0004, BinInDspace=True, FilterBadPulses=True,
SaveAs="gsas", OutputDirectory=savedir,
FinalDataUnits="dSpacing")
# needs to be set for ConjoinFiles to work
config['default.facility'] = 'SNS'
config['default.instrument'] = 'POWGEN'
# load back in the resulting gsas files
ConjoinFiles(RunNumbers=[9829,9830], OutputWorkspace='ConjoinFilesTest', Directory=savedir)
# convert units makes sure the geometry was picked up
ConvertUnits(InputWorkspace='ConjoinFilesTest', OutputWorkspace='ConjoinFilesTest',
Target="dSpacing")
# prepare for validation
LoadGSS(Filename="PG3_9829.gsa", OutputWorkspace="PG3_9829")
LoadGSS(Filename=self.ref_files[0], OutputWorkspace="PG3_4844_golden")
#LoadGSS("PG3_9830.gsa", "PG3_9830") # can only validate one workspace
#LoadGSS(self.ref_file[1], "PG3_9830_golden")
def validateMethod(self):
return None # it running is all that we need
def validate(self):
self.tolerance = 1.0e-2
return ('PG3_9829','PG3_9829_golden')
#return ('PG3_9830','PG3_9830_golden') # can only validate one workspace