/** * This function handles the logic for summing RebinnedOutput workspaces. * @param outputWorkspace the workspace to hold the summed input * @param progress the progress indicator * @param numSpectra * @param numMasked * @param numZeros */ void SumSpectra::doRebinnedOutput(MatrixWorkspace_sptr outputWorkspace, Progress &progress, size_t &numSpectra, size_t &numMasked, size_t &numZeros) { // Get a copy of the input workspace MatrixWorkspace_sptr in_ws = getProperty("InputWorkspace"); // First, we need to clean the input workspace for nan's and inf's in order // to treat the data correctly later. This will create a new private // workspace that will be retrieved as mutable. auto localworkspace = replaceSpecialValues(in_ws); // Transform to real workspace types RebinnedOutput_sptr inWS = boost::dynamic_pointer_cast<RebinnedOutput>(localworkspace); RebinnedOutput_sptr outWS = boost::dynamic_pointer_cast<RebinnedOutput>(outputWorkspace); // Get references to the output workspaces's data vectors auto &outSpec = outputWorkspace->getSpectrum(0); auto &YSum = outSpec.mutableY(); auto &YError = outSpec.mutableE(); auto &FracSum = outWS->dataF(0); std::vector<double> Weight; std::vector<size_t> nZeros; if (m_calculateWeightedSum) { Weight.assign(YSum.size(), 0); nZeros.assign(YSum.size(), 0); } numSpectra = 0; numMasked = 0; numZeros = 0; const auto &spectrumInfo = localworkspace->spectrumInfo(); // Loop over spectra for (const auto i : m_indices) { // Don't go outside the range. if ((i >= m_numberOfSpectra) || (i < 0)) { g_log.error() << "Invalid index " << i << " was specified. Sum was aborted.\n"; break; } if (spectrumInfo.hasDetectors(i)) { // Skip monitors, if the property is set to do so if (!m_keepMonitors && spectrumInfo.isMonitor(i)) continue; // Skip masked detectors if (spectrumInfo.isMasked(i)) { numMasked++; continue; } } numSpectra++; // Retrieve the spectrum into a vector const auto &YValues = localworkspace->y(i); const auto &YErrors = localworkspace->e(i); const auto &FracArea = inWS->readF(i); if (m_calculateWeightedSum) { for (int k = 0; k < this->m_yLength; ++k) { if (YErrors[k] != 0) { double errsq = YErrors[k] * YErrors[k] * FracArea[k] * FracArea[k]; YError[k] += errsq; Weight[k] += 1. / errsq; YSum[k] += YValues[k] * FracArea[k] / errsq; FracSum[k] += FracArea[k]; } else { nZeros[k]++; FracSum[k] += FracArea[k]; } } } else { for (int k = 0; k < this->m_yLength; ++k) { YSum[k] += YValues[k] * FracArea[k]; YError[k] += YErrors[k] * YErrors[k] * FracArea[k] * FracArea[k]; FracSum[k] += FracArea[k]; } } // Map all the detectors onto the spectrum of the output outSpec.addDetectorIDs(localworkspace->getSpectrum(i).getDetectorIDs()); progress.report(); } if (m_calculateWeightedSum) { numZeros = 0; for (size_t i = 0; i < Weight.size(); i++) { if (numSpectra > nZeros[i]) YSum[i] *= double(numSpectra - nZeros[i]) / Weight[i]; if (nZeros[i] != 0) numZeros += nZeros[i]; } } // Create the correct representation outWS->finalize(); }
void ModeratorTzero::execEvent(const std::string &emode) { g_log.information("Processing event workspace"); const MatrixWorkspace_const_sptr matrixInputWS = getProperty("InputWorkspace"); // generate the output workspace pointer API::MatrixWorkspace_sptr matrixOutputWS = getProperty("OutputWorkspace"); if (matrixOutputWS != matrixInputWS) { matrixOutputWS = matrixInputWS->clone(); setProperty("OutputWorkspace", matrixOutputWS); } auto outputWS = boost::dynamic_pointer_cast<EventWorkspace>(matrixOutputWS); // calculate tof shift once for all neutrons if emode==Direct double t0_direct(-1); if (emode == "Direct") { Kernel::Property *eiprop = outputWS->run().getProperty("Ei"); double Ei = boost::lexical_cast<double>(eiprop->value()); mu::Parser parser; parser.DefineVar("incidentEnergy", &Ei); // associate E1 to this parser parser.SetExpr(m_formula); t0_direct = parser.Eval(); } const auto &spectrumInfo = outputWS->spectrumInfo(); const double Lss = spectrumInfo.l1(); // Loop over the spectra const size_t numHists = static_cast<size_t>(outputWS->getNumberHistograms()); Progress prog(this, 0.0, 1.0, numHists); // report progress of algorithm PARALLEL_FOR_IF(Kernel::threadSafe(*outputWS)) for (int i = 0; i < static_cast<int>(numHists); ++i) { PARALLEL_START_INTERUPT_REGION size_t wsIndex = static_cast<size_t>(i); EventList &evlist = outputWS->getSpectrum(wsIndex); if (evlist.getNumberEvents() > 0) // don't bother with empty lists { double L1(Lss); // distance from source to sample double L2(-1); // distance from sample to detector if (spectrumInfo.hasDetectors(i)) { if (spectrumInfo.isMonitor(i)) { // redefine the sample as the monitor L1 = Lss + spectrumInfo.l2(i); // L2 in SpectrumInfo defined negative L2 = 0; } else { L2 = spectrumInfo.l2(i); } } else { g_log.error() << "Unable to calculate distances to/from detector" << i << '\n'; } if (L2 >= 0) { // One parser for each parallel processor needed (except Edirect mode) double E1; mu::Parser parser; parser.DefineVar("incidentEnergy", &E1); // associate E1 to this parser parser.SetExpr(m_formula); // fast neutrons are shifted by min_t0_next, irrespective of tof double v1_max = L1 / m_t1min; E1 = m_convfactor * v1_max * v1_max; double min_t0_next = parser.Eval(); if (emode == "Indirect") { double t2(-1.0); // time from sample to detector. (-1) signals error if (spectrumInfo.isMonitor(i)) { t2 = 0.0; } else { static const double convFact = 1.0e-6 * sqrt(2 * PhysicalConstants::meV / PhysicalConstants::NeutronMass); std::vector<double> wsProp = spectrumInfo.detector(i).getNumberParameter("Efixed"); if (!wsProp.empty()) { double E2 = wsProp.at(0); //[E2]=meV double v2 = convFact * sqrt(E2); //[v2]=meter/microsec t2 = L2 / v2; } else { // t2 is kept to -1 if no Efixed is found g_log.debug() << "Efixed not found for detector " << i << '\n'; } } if (t2 >= 0) // t2 < 0 when no detector info is available { // fix the histogram bins auto &x = evlist.mutableX(); for (double &tof : x) { if (tof < m_t1min + t2) tof -= min_t0_next; else tof -= CalculateT0indirect(tof, L1, t2, E1, parser); } MantidVec tofs = evlist.getTofs(); for (double &tof : tofs) { if (tof < m_t1min + t2) tof -= min_t0_next; else tof -= CalculateT0indirect(tof, L1, t2, E1, parser); } evlist.setTofs(tofs); evlist.setSortOrder(Mantid::DataObjects::EventSortType::UNSORTED); } // end of if( t2>= 0) } // end of if(emode=="Indirect") else if (emode == "Elastic") { // Apply t0 correction to histogram bins auto &x = evlist.mutableX(); for (double &tof : x) { if (tof < m_t1min * (L1 + L2) / L1) tof -= min_t0_next; else tof -= CalculateT0elastic(tof, L1 + L2, E1, parser); } MantidVec tofs = evlist.getTofs(); for (double &tof : tofs) { // add a [-0.1,0.1] microsecond noise to avoid artifacts // resulting from original tof data if (tof < m_t1min * (L1 + L2) / L1) tof -= min_t0_next; else tof -= CalculateT0elastic(tof, L1 + L2, E1, parser); } evlist.setTofs(tofs); evlist.setSortOrder(Mantid::DataObjects::EventSortType::UNSORTED); } // end of else if(emode=="Elastic") else if (emode == "Direct") { // fix the histogram bins evlist.mutableX() -= t0_direct; MantidVec tofs = evlist.getTofs(); for (double &tof : tofs) { tof -= t0_direct; } evlist.setTofs(tofs); evlist.setSortOrder(Mantid::DataObjects::EventSortType::UNSORTED); } // end of else if(emode=="Direct") } // end of if(L2 >= 0) } // end of if (evlist.getNumberEvents() > 0) prog.report(); PARALLEL_END_INTERUPT_REGION } // end of for (int i = 0; i < static_cast<int>(numHists); ++i) PARALLEL_CHECK_INTERUPT_REGION outputWS->clearMRU(); // Clears the Most Recent Used lists */ } // end of void ModeratorTzero::execEvent()
/** * This function deals with the logic necessary for summing a Workspace2D. * @param outSpec The spectrum for the summed output. * @param progress The progress indicator. * @param numSpectra The number of spectra contributed to the sum. * @param numMasked The spectra dropped from the summations because they are * masked. * @param numZeros The number of zero bins in histogram workspace or empty * spectra for event workspace. */ void SumSpectra::doWorkspace2D(ISpectrum &outSpec, Progress &progress, size_t &numSpectra, size_t &numMasked, size_t &numZeros) { // Get references to the output workspaces's data vectors auto &OutputYSum = outSpec.mutableY(); auto &OutputYError = outSpec.mutableE(); std::vector<double> Weight; std::vector<size_t> nZeros; if (m_calculateWeightedSum) { Weight.assign(OutputYSum.size(), 0); nZeros.assign(OutputYSum.size(), 0); } numSpectra = 0; numMasked = 0; numZeros = 0; MatrixWorkspace_sptr in_ws = getProperty("InputWorkspace"); // Clean workspace of any NANs or Inf values auto localworkspace = replaceSpecialValues(in_ws); const auto &spectrumInfo = localworkspace->spectrumInfo(); // Loop over spectra for (const auto wsIndex : this->m_indices) { // Don't go outside the range. if ((wsIndex >= this->m_numberOfSpectra) || (wsIndex < 0)) { g_log.error() << "Invalid index " << wsIndex << " was specified. Sum was aborted.\n"; break; } if (spectrumInfo.hasDetectors(wsIndex)) { // Skip monitors, if the property is set to do so if (!m_keepMonitors && spectrumInfo.isMonitor(wsIndex)) continue; // Skip masked detectors if (spectrumInfo.isMasked(wsIndex)) { numMasked++; continue; } } numSpectra++; const auto &YValues = localworkspace->y(wsIndex); const auto &YErrors = localworkspace->e(wsIndex); // Retrieve the spectrum into a vector for (int i = 0; i < m_yLength; ++i) { if (m_calculateWeightedSum) { if (std::isnormal(YErrors[i])) { const double errsq = YErrors[i] * YErrors[i]; OutputYError[i] += errsq; Weight[i] += 1. / errsq; OutputYSum[i] += YValues[i] / errsq; } else { nZeros[i]++; } } else { OutputYSum[i] += YValues[i]; OutputYError[i] += YErrors[i] * YErrors[i]; } } // Map all the detectors onto the spectrum of the output outSpec.addDetectorIDs( localworkspace->getSpectrum(wsIndex).getDetectorIDs()); progress.report(); } if (m_calculateWeightedSum) { numZeros = 0; for (size_t i = 0; i < Weight.size(); i++) { if (numSpectra > nZeros[i]) OutputYSum[i] *= double(numSpectra - nZeros[i]) / Weight[i]; if (nZeros[i] != 0) numZeros += nZeros[i]; } } }