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At least 1,387 records · Page 77

DBSchema_DMS

PRISM Data Management System database schema. This is a collection of DDL files that define the database schema used by the Data Management System (DMS) component of the Pan-Omics Research Information Storage and Management system (PRISM) at the Pacific Northwest National Laboratory (PNNL). PRISM incorporates a diverse set of analysis tools and allows a wide range of operations to be incorporated, leveraing a state machine that is accessible to independent, distributed computational nodes. The system has scaled well as data volume has increased since 2002, while allowing adaptability for incorporating new and improved data analysis tools for more effective proteomics research.

Monroe, Matthew↗

Remote Sensing System Requirements Development: A Simulation-Based Approach

Earth science research and application requirements for multispectral data have often been driven by currently available remote sensing technology. Few parametric studies exist that specify data required for certain applications. Consequently, data requirements are often defined based on the best data available or on what has worked successfully in the past. Since properites such as spatial resolution, swath width, spectral bands, signal-to-noise ratio (SNR), data quantization, and band-to-band registration drive sensor platform and spaceraft system architecture and cost, analysis of these criteria is important to objectively optimize system design. Remote sensing data requirements are also linked to calibration and characterization methods. Parameters such as spatial resolution, radiometric accuracy, and geopositional accuracy affect the complexity and cost of calibration methods. However, there are few studies that quantify the true accuracies required for specific problems. As calibration methods and standards are proposed, it is important that they be tied to well-known data requirements. The Application Research Toolbox (ART) developed at Stennis Space Center provides a simulation-based method for multispectral data requirements development. The ART produces simulated data sets from hyperspectral data through band synthesis. Parameters such as spectral band shape and width, SNR, data quantization, spatial resolution, and band-to-band registration can be varied to create many different simulated data products. Simulated data utility can then be assessed for different applications so that requirements can be better understood. This paper describes the ART and its applicability for rigorously deriving remote sensing data requirements.

Zanoni, Vicki↗

Increased fissionable material loading of vitrified borosilicate glass in support of efficient disposition of nuclear materials at Savannah River - 15299

The US DOE is vitrifying liquid HLW, converting it into a glass form suitable for long term storage and disposal. The waste includes fissionable isotopes and, as a consequence, may possess an inadvertent criticality hazard. The technical basis for determining when an inadvertent criticality hazard exists is unclear. ANS criticality safety standards do not provide relevant subcritical safety limits and little experimental data exist to support development of such a limit. As a result, the DOE has implemented a conservative limit of 897 grams of fissile nuclides per cubic meter of glass. However, this limit has the potential to impede efficient disposal of various fissionable materials at the Savannah River Site. Work is being conducted to establish an alternate fissionable material limit which would be less restrictive, but still ensure criticality safety. A series of computer models are constructed and analyzed using a general purpose Monte Carlo N-Particle neutron transport code. First, a baseline model is established and analyzed. Next, numerous variations to the baseline model (i.e., perturbations) are analyzed with the code to understand the impact of the change. Based on the results, it is evident the atomic ratio of B-10 to equivalent Pu-239 would be an effective means to ensure subcriticality of HLW vitrified in a borosilicate glass matrix. The proposed limit, its technical basis, and all necessary application constraints are discussed. This proposed limit is expected to permit significantly higher quantities of fissile nuclides in the vitrified waste form. It will also account for several non-fissile, fissionable nuclides which are expected to add reactivity to the glass waste form. The proposed limit embodies large conservatisms intended to provide assurance of safety in spite of the significant uncertainties associated with its development. The single most important uncertainty arises from the inability to validate the calculations which form its technical basis. While they are done with the latest available nuclear data and well established analytical methods, they are, nonetheless, not validated as required for subcritical safety limits. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

THE 2012 HUBBLE ULTRA DEEP FIELD (UDF12): OBSERVATIONAL OVERVIEW

We present the 2012 Hubble Ultra Deep Field campaign (UDF12), a large 128 orbit Cycle 19 Hubble Space Telescope program aimed at extending previous Wide Field Camera 3 (WFC3)/IR observations of the UDF by quadrupling the exposure time in the F105W filter, imaging in an additional F140W filter, and extending the F160W exposure time by 50%, as well as adding an extremely deep parallel field with the Advanced Camera for Surveys (ACS) in the F814W filter with a total exposure time of 128 orbits. The principal scientific goal of this project is to determine whether galaxies reionized the universe; our observations are designed to provide a robust determination of the star formation density at z ∼> 8, improve measurements of the ultraviolet continuum slope at z ∼ 7-8, facilitate the construction of new samples of z ∼ 9-10 candidates, and enable the detection of sources up to z ∼ 12. For this project we committed to combining these and other WFC3/IR imaging observations of the UDF area into a single homogeneous dataset to provide the deepest near-infrared observations of the sky. In this paper we present the observational overview of the project and describe the procedures used in reducing the data as well as the final products that were produced. We present the details of several special procedures that we implemented to correct calibration issues in the data for both the WFC3/IR observations of the main UDF field and our deep 128 orbit ACS/WFC F814W parallel field image, including treatment for persistence, correction for time-variable sky backgrounds, and astrometric alignment to an accuracy of a few milliarcseconds. We release the full, combined mosaics comprising a single, unified set of mosaics of the UDF, providing the deepest near-infrared blank-field view of the universe currently achievable, reaching magnitudes as deep as AB ∼ 30 mag in the near-infrared, and yielding a legacy dataset on this field.

79 ASTRONOMY AND ASTROPHYSICS↗

Analytical modeling and numerical simulation of the short-wave infrared electron-injection detectors

This paper describes comprehensive analytical and simulation models for the design and optimization of the electron-injection based detectors. The electron-injection detectors evaluated here operate in the short-wave infrared range and utilize a type-II band alignment in InP/GaAsSb/InGaAs material system. The unique geometry of detectors along with an inherent negative-feedback mechanism in the device allows for achieving high internal avalanche-free amplifications without any excess noise. Physics-based closed-form analytical models are derived for the detector rise time and dark current. Our optical gain model takes into account the drop in the optical gain at high optical power levels. Furthermore, numerical simulation studies of the electrical characteristics of the device show good agreement with our analytical models as well experimental data. Performance comparison between devices with different injector sizes shows that enhancement in the gain and speed is anticipated by reducing the injector size. Sensitivity analysis for the key detector parameters shows the relative importance of each parameter. The results of this study may provide useful information and guidelines for development of future electron-injection based detectors as well as other heterojunction photodetectors.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Guide to Using the WIND Toolkit Validation Code

In response to the U.S. Department of Energy's goal of using 20% wind energy by 2030, the Wind Integration National Dataset (WIND) Toolkit was created to provide information on wind speed, wind direction, temperature, surface air pressure, and air density on more than 126,000 locations across the United States from 2007 to 2013. The numerical weather prediction model output, gridded at 2-km and at a 5-minute resolution, was further converted to detail the wind power production time series of existing and potential wind facility sites. For users of the dataset it is important that the information presented in the WIND Toolkit is accurate and that errors are known, as then corrective steps can be taken. Therefore, we provide validation code written in R that will be made public to provide users with tools to validate data of their own locations. Validation is based on statistical analyses of wind speed, using error metrics such as bias, root-mean-square error, centered root-mean-square error, mean absolute error, and percent error. Plots of diurnal cycles, annual cycles, wind roses, histograms of wind speed, and quantile-quantile plots are created to visualize how well observational data compares to model data. Ideally, validation will confirm beneficial locations to utilize wind energy and encourage regional wind integration studies using the WIND Toolkit.

17 WIND ENERGY↗

CACTI Radar b1 Processing: Corrections, Calibrations, and Processing Report

The U.S. Department of Energy’s (DOE) Atmospheric Radiation Measurement (ARM) user facility deployed a large number of instruments to a region nearby the Sierra de Córdobas mountains in Argentina as part of the Cloud, Aerosol, and Complex Terrain Interactions (CACTI) field campaign (1). During this campaign, four radars were installed at a site outside of Villa Yacanto as shown in Figure 1. As part of a post-campaign effort to improve the usability of these data, a significant activity was undertaken towards the calibration, correction, and improvement of the data quality of these radar datastreams. This process in ARM nomenclature is referred to as generating a “b1” datastream. While these “b1” standards may imply different corrections or standards for various ARM instruments, for radars it refers to a datastream that has been calibrated (and cross-calibrated), including a serious effort to deliver the highest-quality (well-characterized) data possible. This report details (i) the status/quality of the original “a1” (raw) data, (ii) the corrections and calibrations that are applied to generate these b1 datastreams, (iii) the details of the applied algorithms and how radar offset/calibration numbers were determined for the eventual corrections, and (iv) the new and flexible plug-in-based processing system designed during CACTI for radar b1 activities (current, future) that interfaces with ARM’s Data Integrator (ADI) and high-performance computing (HPC) system.

47 OTHER INSTRUMENTATION↗

Fractal analysis of Venus topography in Tinatin Planitia and Ovda Regio

A one-dimensional fractal analysis is applied to Magellan altimetry data for two 20 x 20 deg equatorial regions on Venus. For the Ovda Regio, highlands the power spectra of the altimetry data correlate well with power law (fractal) statistics over the full range of wavelengths considered 36-703 km; the mean fractal dimension is D(Ovda) = 1.64. For the Tinatin Planitia lowlands, the power spectra consistently show a rollover at long wavelengths, (greater than 200 km), the long-wavelength topography in this region either never developed or has subsequently relaxed. The mean of the best fit fractal dimension for Tinatin is D(Tinatin) = 1.41. The measure of roughness (RA) correlates well with variations in relief, especially at short wavelengths (about 50 km). The quantitative analysis of Venus topography can be applied on a global scale. The one-dimensional method can be extended to two-dimensional space, yielding two-dimensional maps of regional D and RA, allowing a more complete use of regional two-dimensional altimetry data.

Kucinskas, Algis B.↗

New-Generation NASA Aura Ozone Monitoring Instrument (OMI) Volcanic SO2 Dataset: Algorithm Description, Initial Results, and Continuation with the Suomi-NPP Ozone Mapping and Profiler Suite (OMPS)

Since the fall of 2004, the Ozone Monitoring Instrument (OMI) has been providing global monitoring of volcanic SO2 emissions, helping to understand their climate impacts and to mitigate aviation hazards. Here we introduce a new-generation OMI volcanic SO2 dataset based on a principal component analysis (PCA) retrieval technique. To reduce retrieval noise and artifacts as seen in the current operational linear fit (LF) algorithm, the new algorithm, OMSO2VOLCANO, uses characteristic features extracted directly from OMI radiances in the spectral fitting, thereby helping to minimize interferences from various geophysical processes (e.g., O3 absorption) and measurement details (e.g., wavelength shift). To solve the problem of low bias for large SO2 total columns in the LF product, the OMSO2VOLCANO algorithm employs a table lookup approach to estimate SO2 Jacobians (i.e., the instrument sensitivity to a perturbation in the SO2 column amount) and iteratively adjusts the spectral fitting window to exclude shorter wavelengths where the SO2 absorption signals are saturated. To first order, the effects of clouds and aerosols are accounted for using a simple Lambertian equivalent reflectivity approach. As with the LF algorithm, OMSO2VOLCANO provides total column retrievals based on a set of predefined SO2 profiles from the lower troposphere to the lower stratosphere, including a new profile peaked at 13 km for plumes in the upper troposphere. Examples given in this study indicate that the new dataset shows significant improvement over the LF product, with at least 50% reduction in retrieval noise over the remote Pacific. For large eruptions such as Kasatochi in 2008 (approximately 1700 kt total SO2/ and Sierra Negra in 2005 (greater than 1100DU maximum SO2), OMSO2VOLCANO generally agrees well with other algorithms that also utilize the full spectral content of satellite measurements, while the LF algorithm tends to underestimate SO2. We also demonstrate that, despite the coarser spatial and spectral resolution of the Suomi National Polar-orbiting Partnership (Suomi-NPP) Ozone Mapping and Profiler Suite (OMPS) instrument, application of the new PCA algorithm to OMPS data produces highly consistent retrievals between OMI and OMPS. The new PCA algorithm is therefore capable of continuing the volcanic SO2 data record well into the future using current and future hyperspectral UV satellite instruments.

OMI↗

Comparison of Temperature Measurements in the Middle Atmosphere by Satellite with Profiles Obtained by Meteorological Rockets

Measurements using the inflatable falling sphere technique have occasionally been used to obtain temperature results from density data and thereby provide comparison with temperature profiles obtained by satellite sounders in the mesosphere and stratosphere. To insure density measurements within narrow time frames and close in space, the inflatable falling sphere is launched within seconds of the nearly overhead satellite pass. Sphere measurements can be used to validate remotely measured temperatures but also have the advantage of measuring small-scale atmospheric features. Even so, with the dearth of remaining falling spheres available (the manufacture of these systems has been discontinued), it may be time to consider whether the remote measurements are mature enough to stand alone. Three field studies are considered, one in 2003 from Northern Sweden, and two in 2010 from the vicinity of Kwajalein Atoll in the South Pacific and from Barking Sands, Hawaii. All three sites are used to compare temperature retrievals between satellite and in situ falling spheres. The major satellite instruments employed are SABER, MLS, and AIRS. The comparisons indicate that remotely measured temperatures mimic the sphere temperature measurements quite well. The data also confirm that satellite retrievals, while not always at the exact location required for detailed studies in space and time, compare sufficiently well to be highly useful. Although the falling sphere will provide a measurement at a specific location and time, satellites only pass a given location daily or less frequently. This report reveals that averaged satellite measurements can provide temperatures and densities comparable to those obtained from the falling sphere, thereby providing a reliable measure of global temperature

Goldberg, Richard A.↗

Microseismicity Modulation Due To Changes in Geothermal Production at San Emidio, Nevada, USA

Brief cessations of geothermal production can induce seismicity, a phenomenon that has drawn increasing attention in recent years. Such observations are rare, and the underlying mechanism requires careful analysis. In April 2022, a dense seismic and hydrologic monitoring system was deployed at the San Emidio geothermal field, Nevada, to accompany a planned power plant shutdown. Using the dense seismic array data, we detected and located ∼1,800 microseismic events (MSEs) and developed a high-resolution tomographic P-wave velocity model. We observed substantially increased microseismicity during shutdown. Most MSEs occurred on pre-existing normal faults, which are contained within extremely low-velocity zones that are likely damaged, fluid-filled, and hydraulically connected to nearby production wells. Hydrologic data show rapid fluid pressure increases of <60 kPa following the shutdown. We suggest that the cessation of production rapidly increased fluid pressures along pre-existing fault zones, activating critically stressed fault patches and fractures and producing microseismicity.

Guo, Hao [University of Wisconsin-Madison, WI (Uni↗

Account of nonlocal ionization by fast electrons in the fluid models of a direct current glow discharge

We developed and tested a simple hybrid model for a glow discharge, which incorporates nonlocal ionization by fast electrons into the 'simple' and 'extended' fluid frameworks. Calculations have been performed for an argon gas. Comparison with the experimental data as well as with the hybrid (particle) and fluid modelling results demonstated good applicability of the proposed model.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

EXILL—a high-efficiency, high-resolution setup for γ-spectroscopy at an intense cold neutron beam facility

In the EXILL campaign a highly efficient array of high purity germanium (HPGe) detectors was operated at the cold neutron beam facility PF1B of the Institut Laue-Langevin (ILL) to carry out nuclear structure studies, via measurements of γ-rays following neutron-induced capture and fission reactions. The setup consisted of a collimation system producing a pencil beam with a thermal capture equivalent flux of about 10 8 n s -1 cm -2 at the target position and negligible neutron halo. The target was surrounded by an array of eight to ten anti-Compton shielded EXOGAM Clover detectors, four to six anti-Compton shielded large coaxial GASP detectors and two standard Clover detectors. For a part of the campaign the array was combined with 16 LaBr 3 :(Ce) detectors from the FATIMA collaboration. The detectors were arranged in an array of rhombicuboctahedron geometry, providing the possibility to carry out very precise angular correlation and directional-polarization correlation measurements. The triggerless acquisition system allowed a signal collection rate of up to 6 × 10 5 Hz. The data allowed to set multi-fold coincidences to obtain decay schemes and in combination with the FATIMA array of LaBr 3 :(Ce) detectors to analyze half-lives of excited levels in the pico- to microsecond range. Precise energy and efficiency calibrations of EXILL were performed using standard calibration sources of 133 Ba, 60 Co and 152 Eu as well as data from the reactions 27 Al(n,γ) 28 Al and 35 Cl(n,γ) 36 Cl in the energy range from 30 keV up to 10 MeV.

47 OTHER INSTRUMENTATION↗

Influence of Reservoir Heterogeneity on Geothermal Fluid and Methane Recovery from a Geopressured Geothermal Reservoir (Presentation)

Geopressured geothermal reservoirs are characterized by high temperatures and high pressures with correspondingly large quantities of dissolved methane. Two methods utilizing reservoir simulation techniques have been used to estimate recoverability factors of geothermal brine and methane based on well log data from a specific reservoir in Texas. The first assumes a simplified reservoir that hasthree layers: upper shale, sandstone, and lower shale with the sandstone layer thickness equal to the net sandstone in the reservoir interval. The second method uses a detailed reservoir model that accounts for multiple sandstone and shale layering. This method includes 12 layers of sandstone or shale with the layer depths determined from a well log. These two methods are used to answer thequestion on the sensitivity of the results to the level of detail that is included in the reservoir model. It was found that incorporating multiple thin layers of lower permeability sandstone can noticeably impact the results of the reservoir simulation. The heterogeneous model resulted in greater flow rates of both geothermal brine and total methane. Both models demonstrate that thegeopressured geothermal reservoir is capable of producing hot geothermal fluid at flow rates over a long duration that are sufficient for electricity production from binary power plants. The results indicate that simplified models of geopressured geothermal reservoirs that approximate actual reservoir details can be applied to give a reasonable, albeit conservative, estimate of the recoverableresource over broad areas using generalized data sets.

15 GEOTHERMAL ENERGY↗

Modeling CH 4 and CO 2 cycling using porewater stable isotopes in a thermokarst bog in Interior Alaska: results from three conceptual reaction networks

Quantifying rates of microbial carbon transformation in peatlands is essential for gaining mechanistic understanding of the factors that influence methane emissions from these systems, and for predicting how emissions will respond to climate change and other disturbances. In this study, we used porewater stable isotopes collected from both the edge and center of a thermokarst bog in Interior Alaska to estimate in situ microbial reaction rates. We expected that near the edge of the thaw feature, actively thawing permafrost and greater abundance of sedges would increase carbon, oxygen and nutrient availability, enabling faster microbial rates relative to the center of the thaw feature. We developed three different conceptual reaction networks that explained the temporal change in porewater CO2, CH4, δ13C-CO2 and δ13C-CH4. All three reaction-network models included methane production, methane oxidation and CO2 production, and two of the models included homoacetogenesis — a reaction not previously included in isotope-based porewater models. All three models fit the data equally well, but rates resulting from the models differed. Most notably, inclusion of homoacetogenesis altered the modeled pathways of methane production when the reaction was directly coupled to methanogenesis, and it decreased gross methane production rates by up to a factor of five when it remained decoupled from methanogenesis. The ability of all three conceptual reaction networks to successfully match the measured data indicate that this technique for estimating in-situ reaction rates requires other data and information from the site to confirm the considered set of microbial reactions. Despite these differences, all models indicated that, as expected, rates were greater at the edge than in the center of the thaw bog, that rates at the edge increased more during the growing season than did rates in the center, and that the ratio of acetoclastic to hydrogenotrophic methanogenesis was greater at the edge than in the center. In both locations, modeled rates (excluding methane oxidation) increased with depth. A puzzling outcome from the effort was that none of the models could fit the porewater dataset without generating “fugitive” carbon (i.e., methane or acetate generated by the models but not detected at the field site), indicating that either our conceptualization of the reactions occurring at the site remains incomplete or our site measurements are missing important carbon transformations and/or carbon fluxes. This model–data discrepancy will motivate and inform future research efforts focused on improving our understanding of carbon cycling in permafrost wetlands.

13CH4↗

Relativistic equation-of-motion coupled-cluster method using open-shell reference wavefunction: Application to ionization potential

The open-shell reference relativistic equation-of-motion coupled-cluster method within its four-component description is successfully implemented with the consideration of single- and double- excitation approximations using the Dirac-Coulomb Hamiltonian. At the first attempt, the implemented method is employed to calculate ionization potential value of heavy atomic (Ag, Cs, Au, Fr, and Lr) and molecular (HgH and PbF) systems, where the effect of relativity does really matter to obtain highly accurate results. Not only the relativistic effect but also the effect of electron correlation is crucial in these heavy atomic and molecular systems. To justify the fact, we have taken two further approximations in the four-component relativistic equation-of-motion framework to quantify how the effect of electron correlation plays a role in the calculated values at different levels of theory. All these calculated results are compared with the available experimental data as well as with other theoretically calculated values to judge the extent of accuracy obtained in our calculations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Geochemistry, RNA radiocarbon signature, and metatranscriptome data from Rifle, Colorado groundwater well

Understanding the different sources of carbon subsurface microbes use is highly informative yet remains challenging. The goal of this work was to develop and test a cultivation-independent method that analyzes both the radiocarbon and ribosomal RNA (rRNA) signature of unamplified RNA from the same environmental sample, and that collectively characterizes community carbon utilization under in situ conditions. The method was applied to a filtered groundwater sample from a geochemically reduced zone of a shallow alluvial aquifer near Rife, Colorado (CO), where multiple potential carbon sources co-occur. The radiocarbon and RNA-Seq results, while addressing diverse sample properties, indicated a strikingly similar conclusion about the quantitative role of autotrophy in the subsurface microbial community.This data package provides (1) ribosomal RNA (rRNA) sequences for groundwater microbial populations, (2) the taxonomic identity and relative abundance of groundwater microbial populations based on these rRNA sequences, (3) radiocarbon signatures of the rRNA indicating the source of carbon used by the groundwater microbial populations (provided in both Word docx file and pdf file), (4) geochemical measurements for the monitoring well corresponding to these measurements.

54 ENVIRONMENTAL SCIENCES↗

Fast Plasma Investigation for MMS: Simulation of the Burst Triggering System

The Magnetospheric Multiscale (MMS) mission will study small-scale reconnection structures and their rapid motions from closely spaced platforms using instruments capable of high angular, energy, and time resolution measurements. To meet these requirements, the Fast Plasma Instrument (FPI) consists of eight (8) identical half top-hat electron sensors and eight (8) identical ion sensors and an Instrument Data Processing Unit (IDPU). The sensors (electron or ion) are grouped into pairs whose 6 degree x 180 degree fields-of-view (FOV) are set 90 degrees apart. Each sensor is equipped with electrostatic aperture steering to allow the sensor to scan a 45 degree x 180 degree fan about the its nominal viewing (0 deflection) direction. Each pair of sensors, known as the Dual Electron Spectrometer (DES) and the Dual Ion Spectrometer (DIS), occupies a quadrant on the MMS spacecraft and the combination of the eight electron/ion sensors, employing aperture steering, image the full-sky every 30-ms (electrons) and 150-ms (ions), respectively. To probe the diffusion regions of reconnection, the highest temporal/spatial resolution mode of FPI results in the DES complement of a given spacecraft generating 6.5-Mb (raised dot) per second of electron data while the DIS generates 1.1-Mb (raised dot) per second of ion data yielding an FPI total data rate of 6.6-Mb (raised dot) per second. The FPI electron/ion data is collected by the IDPU then transmitted to the Central Data Instrument Processor (CIDP) on the spacecraft for science interest ranking. Only data sequences that contain the greatest amount of temporal/spatial structure will be intelligently down-linked by the spacecraft. This requires a data ranking process known as the burst trigger system. The burst trigger system uses pseudo physical quantities to approximate the local plasma environments. As each pseudo quantity will have a different value, a set of two scaling factors is employed for each pseudo term. These pseudo quantities are then combined at the instrument, spacecraft, and observatory level leading to a final ranking of data based on expected scientific interest. Here, we present simulations of the fixed point burst trigger system for the FPI. A variety of data sets based on previous mission data as well as analytical formulations are tested. Comparisons of floating point calculations versus the fixed point hardware simulation are shown. Analysis of the potential sources of error from overflows, quantization, etc. are examined and mitigation methods are presented. Finally a series of calibration curves are presented, showing the expected error in pseudo quantities based solely on the scale parameters chosen and the expected data range. We conclude with a presentation of the current base-lined FPI burst trigger approach.

Barrie, A. C.↗