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At least 1,369 records · Page 76Linked to original sources

The effects of α-cellulose extraction and blue-stain fungus on retrospective studies of carbon and oxygen isotope variation in live and dead trees†

Tree-ring carbon and oxygen isotope ratios from live and recently dead trees may reveal important mechanisms of tree mortality. However, wood decay in dead trees may alter the δ 13 C and δ 18 O values of whole wood obscuring the isotopic signal associated with factors leading up to and including physiological death. We examined whole sapwood and α-cellulose from live and dead specimens of ponderosa pine ( Pinus ponderosa ), one-seed juniper ( Juniperous monosperma ), piñon pine ( Pinus edulis ) and white fir ( Abies concolor ), including those with fungal growth and beetle frass in the wood, to determine if α-cellulose extraction is necessary for the accurate interpretation of isotopic compositions in the dead trees. We found that the offset between the δ 13 C or δ 18 O values of α-cellulose and whole wood was the same for both live and dead trees across a large range of inter-annual and regional climate differences. The method of α-cellulose extraction, whether Leavitt-Danzer or Standard Brendel modified for small samples, imparts significant differences in the δ 13 C (up to 0.4‰) and δ 18 O (up to 1.2‰) of α-cellulose, as reported by other studies. There was no effect of beetle frass or blue-stain fungus ( Ophiostoma ) on the δ 13 C and δ 18 O of whole wood or α-cellulose. The relationships between whole wood and α-cellulose δ 13 C for ponderosa, piñon and juniper yielded slopes of ~1, while the relationship between δ 18 O of whole wood and α-cellulose was less clear. We conclude that there are few analytical or sampling obstacles to retrospective studies of isotopic patterns of tree mortality in forests of the western United States.

Rapid Communications in Mass Spectrometry↗

Coseismic and post-seismic gravity disturbance induced by seismic sources using a 2.5-D spectral element method

I present a prescription for computing free-air coseismic and post-seismic gravity changes induced by seismic sources in a viscoelastic earth model. I assume a spherical earth geometry and a 2.5-D calculation, that is, 3-D motions that satisfy the equations of quasi-static equilibrium on a 2-D viscoelastic structure. The prescription permits application to regional gravity computations where a 2-D structure adequately represents the structural heterogeneity. I use a hybrid approach where deformation is computed on a discretized domain and the resulting density perturbations are expanded with spherical harmonics to produce the free-air gravity field. Starting with a solution to the equations of quasi-static displacements in the Laplace transform domain for a given dislocation source, I solve Poisson’s equation using Lagrangian interpolation on spectral element nodes to compute the required deformation quantities that contribute to free-air gravity. A numerical inverse Laplace transform then yields time domain results. This methodology is tested with analytic solutions on a spherically stratified viscoelastic structure, then applied to evaluate the effect of a descending slab of relatively high viscosity on post-seismic gravity in a megathrust faulting setting.

Geophysical Journal International↗

Implementation and modification of a three-dimensional radiation stress formulation for surf zone and rip-current applications

Regional Ocean Modeling System (ROMS v 3.0), a three-dimensional numerical ocean model, was previously enhanced for shallow water applications by including wave-induced radiation stress forcing provided through coupling to wave propagation models (SWAN, REF/DIF). This enhancement made it suitable for surf zone applications as demonstrated using examples of obliquely incident waves on a planar beach and rip current formation in longshore bar trough morphology (Haas and Warner, 2009). In this contribution, we present an update to the coupled model which implements a wave roller model and also a modified method of the radiation stress term based on Mellor (2008, 2011a,b,in press) that includes a vertical distribution which better simulates non-conservative (i.e., wave breaking) processes and appears to be more appropriate for sigma coordinates in very shallow waters where wave breaking conditions dominate. The improvements of the modified model are shown through simulations of several cases that include: (a) obliquely incident spectral waves on a planar beach; (b) obliquely incident spectral waves on a natural barred beach (DUCK'94 experiment); (c) alongshore variable offshore wave forcing on a planar beach; (d) alongshore varying bathymetry with constant offshore wave forcing; and (e) nearshore barred morphology with rip-channels. Quantitative and qualitative comparisons to previous analytical, numerical, laboratory studies and field measurements show that the modified model replicates surf zone recirculation patterns (onshore drift at the surface and undertow at the bottom) more accurately than previous formulations based on radiation stress (Haas and Warner, 2009). The results of the model and test cases are further explored for identifying the forces operating in rip current development and the potential implication for sediment transport and rip channel development. Also, model analysis showed that rip current strength is higher when waves approach at angles of 5° to 10° in comparison to normally incident waves.

Coastal Engineering↗

Soil water retention and maximum capillary drive from saturation to oven dryness

This paper provides an alternative method to describe the water retention curve over a range of water contents from saturation to oven dryness. It makes two modifications to the standard Brooks and Corey [1964] (B-C) description, one at each end of the suction range. One expression proposed by Rossi and Nimmo [1994] is used in the high-suction range to a zero residual water content. (This Rossi-Nimmo modification to the Brooks-Corey model provides a more realistic description of the retention curve at low water contents.) Near zero suction the second modification eliminates the region where there is a change in suction with no change in water content. Tests on seven soil data sets, using three distinct analytical expressions for the high-, medium-, and low-suction ranges, show that the experimental water retention curves are well fitted by this composite procedure. The high-suction range of saturation contributes little to the maximum capillary drive, defined with a good approximation for a soil water and air system as H cM = ∫ 0 ∞ K rw dh c , where k rw is relative permeability (or conductivity) to water and h c is capillary suction, a positive quantity in unsaturated soils. As a result, the modification suggested to describe the high-suction range does not significantly affect the equivalence between Brooks-Corey (B-C) and van Genuchten [1980] parameters presented earlier. However, the shape of the retention curve near “natural saturation” has a significant impact on the value of the capillary drive. The estimate using the Brooks-Corey power law, extended to zero suction, will exceed that obtained with the new procedure by 25 to 30%. It is not possible to tell which procedure is appropriate. Tests on another data set, for which relative conductivity data are available, support the view of the authors that measurements of a retention curve coupled with a speculative curve of relative permeability as from a capillary model are not sufficient to accurately determine the (maximum) capillary drive. The capillary drive is a dynamic scalar, whereas the retention curve is of a static character. Only measurements of infiltration rates with time can determine the capillary drive with precision for a given soil.

Water Resources Research↗

Development and evaluation of a gas chromatographic method for the determination of triazine herbicides in natural water samples

A multi-residue method is described for the determination o triazine herbicides in natural water samples. The technique uses solvent extraction followed by gas chromatographic separation and detection employing nitrogen-selective devices. Seven compounds can be determined simultaneously at a nominal detection limit of 0.1 μg/L in a 1-litre sample. Three different natural water samples were used for error analysis via evaluation of recovery efficiencies and estimation of overall method precision. As an alternative to liquid-liquid partition (solvent extraction) for removal of compounds of interest from water, solid-phase extraction (SPE) techniques employing chromatographic grade silicas with chemically modified surfaces have been examined. SPE is found to provide rapid and efficient concentration with quantitative recovery of some triazine herbicides from natural water samples. Concentration factors of 500 to 1000 times are obtained readily by the SPE technique.

International Journal of Environmental Analytical ↗

WTAQ - A computer program for aquifer-test analysis of confined and unconfined aquifers

Computer program WTAQ was developed to implement a Laplace-transform analytical solution for axial-symmetric flow to a partially penetrating, finite-diameter well in a homogeneous and anisotropic unconfined (water-table) aquifer. The solution accounts for wellbore storage and skin effects at the pumped well, delayed response at an observation well, and delayed or instantaneous drainage from the unsaturated zone. For the particular case of zero drainage from the unsaturated zone, the solution simplifies to that of axial-symmetric flow in a confined aquifer. WTAQ calculates theoretical time-drawdown curves for the pumped well and observation wells and piezometers. The theoretical curves are used with measured time-drawdown data to estimate hydraulic parameters of confined or unconfined aquifers by graphical type-curve methods or by automatic parameter-estimation methods. Parameters that can be estimated are horizontal and vertical hydraulic conductivity, specific storage, and specific yield. A sample application illustrates use of WTAQ for estimating hydraulic parameters of a hypothetical, unconfined aquifer by type-curve methods. Copyright ASCE 2004.

Conference Paper↗

Spectrochemical determination of thorium in monazite by the powder-d.c. arc technique

Thorium in monazite is determined by a d.c. carbon-arc technique using zirconium as the internal standard. The analytical curve for Th II 2870.413 Å/Zr II 2844-579 Å is established by means of synthetic standards containing graduated amounts of thoria and 0.500 per cent zirconia in pegmatite base (60 parts quartz, 40 parts microchne, and 1 part ferric oxide). Monazite samples are diluted 14-fold with pegmatite base that contains 0.538 per cent ZrO 2 , so that the zirconia content of the resulting mixture is also 0.500 per cent. In addition, both the standards and the diluted monazites are mixed with one-half their weight of powdered graphite. Approximately 25 mg of the prepared samples are arced to completion at 15.5 to 17.5 amperes. With the 14-fold dilution employed, the accurate range of the method is 3 to 20 per cent thoria in the original monazite. The coefficient of variation for a single determination is 4 per cent at the 7 per cent thoria level. Tests with synthetic unknowns and chemically analyzed monazites show a maximum error of ±10 per cent of the thoria content. If niobium is substituted for zirconium as the internal standard, there is a loss of precision. Platinum as the internal standard gives results of good precision but introduces a marked sensitivity to matrix effects.

Spectrochimica Acta↗

Proceedings of the third USGS modeling conference, June 7-11, 2010, Broomfield, Colorado-Understanding and predicting for a changing world

The Third USGS Modeling Conference was held June 7th-11, 2010, in Broomfield, Colorado. The conference focused on the development and application of analytical and theoretical models and data availability that support managing the Nation's resources and help protect lives and property. Participants at the conference included scientists and managers from Department of the Interior (DOI) Bureaus; national and international Federal, State, and local agencies; academic institutions; and nongovernmental organizations. The conference was organized according to DOI priorities and the strategic directions of the USGS Science Strategy; the following themes were emphasized: (1) Understanding Ecosystems and Restoring America's Treasured Landscapes; (2) Climate Change and Impact; (3) New Energy Frontier and Minerals for America; (4) A National Hazards, Risk, and Resilience Assessment Program; (5) Role of Environment and Wildlife in Human Health; (6) A Water Census of the United States; and (7) New Methods of Investigation and Discovery. The conference theme-"Understanding and Predicting for a Changing World"-focused on the following goals: advance development and application of models; provide tools that address management issues; present state-of-the-art models ranging from individual phenomena to integrated systems; and foster a working community among scientists and managers.

Scientific Investigations Report↗

Modified determination of radium in water

The proposed method embodies a barium sulfate carrier precipitation, filtration through molecular filter membranes, and collection of activity after prescribed aging period. The method is sufficiently accurate and precise to indicate the potability of water and for use in general studies of radium in chemical hydrology. Amounts of radium as low as 0.1 μ μ c. can be detected by using 1 -hour counting times. Radium-226 is used as the standard and the results indicate about 100 to 110 % of the activity of the alpha-emitting radium isotopes as radium-223, radium-224, and radium-226.

Analytical Chemistry↗

Semiquantitative determination of polychlorinated biphenyls in tissue samples by thin layer chromatography

A method is described for the analysis of polychlorinated biphenyl (PCB) compounds in tissue samples. Cleanup by hexane-acetonitrile partitioning and Florisil column chromatography are performed on samples before oxidative treatment to convert DDE to DCBP. PCB components are then determined semi-quantitatively by TLC. No prior separation of PCB from chlorinated pesticides is required. The lower limit of sensitivity is 0.2 μ g.

Journal of the Association of Official Analytical ↗

Analytical Results for Municipal Biosolids Samples from a Monitoring Program near Deer Trail, Colorado (U.S.A.), 2007

Since late 1993, the Metro Wastewater Reclamation District of Denver (Metro District), a large wastewater treatment plant in Denver, Colorado, has applied Grade I, Class B biosolids to about 52,000 acres of nonirrigated farmland and rangeland near Deer Trail, Colorado (U.S.A.). In cooperation with the Metro District in 1993, the U.S. Geological Survey (USGS) began monitoring ground water at part of this site. In 1999, the USGS began a more comprehensive monitoring study of the entire site to address stakeholder concerns about the potential chemical effects of biosolids applications to water, soil, and vegetation. This more comprehensive monitoring program recently has been extended through 2010. Monitoring components of the more comprehensive study include biosolids collected at the wastewater treatment plant, soil, crops, dust, alluvial and bedrock ground water, and streambed sediment. Streams at the site are dry most of the year, so samples of streambed sediment deposited after rain were used to indicate surface-water effects. This report will present only analytical results for the biosolids samples collected at the Metro District wastewater treatment plant in Denver and analyzed during 2007. We have presented earlier a compilation of analytical results for the biosolids samples collected and analyzed for 1999 through 2006. More information about the other monitoring components is presented elsewhere in the literature. Priority parameters for biosolids identified by the stakeholders and also regulated by Colorado when used as an agricultural soil amendment include the total concentrations of nine trace elements (arsenic, cadmium, copper, lead, mercury, molybdenum, nickel, selenium, and zinc), plutonium isotopes, and gross alpha and beta activity. Nitrogen and chromium also were priority parameters for ground water and sediment components. In general, the objective of each component of the study was to determine whether concentrations of priority parameters (1) were higher than regulatory limits, (2) were increasing with time, or (3) were significantly higher in biosolids-applied areas than in a similar farmed area where biosolids were not applied. Previous analytical results indicate that the elemental composition of the biosolids from the Denver plant was consistent during 1999-2006 and this consistency continues with the samples for 2007; total concentrations of regulated trace elements remained consistently lower than the regulatory limits for the entire monitoring period. Our previously reported data (1999-2006) and data presented in this report were used to compile an inorganic-chemical biosolids signature that can be contrasted with the geochemical signature for this site. The biosolids signature and an understanding of the geology and hydrology of the site can be used to separate biosolids effects from natural geochemical effects. Elements of particular interest for a biosolids signature include bismuth, copper, silver, mercury, phosphorus, and silver. An alternative method of digestion of biosolids was also recently investigated, and the results are presented in this report. A microwave digestion using only nitric acid at controlled elevated temperature and pressure was tested to replace the much more time-consuming and labor-intensive, traditional four-acid, hotplate method for the preparation of solutions to be analyzed by inductively coupled plasma-mass spectrometry (ICP-MS). Elements of concern determined by ICP-MS following digestion include cadmium, copper, lead, molybdenum, nickel, and zinc. The microwave 'digestion' proved to be a strong acid leach, and it was less efficient at digesting the biosolids samples with consistently lower recoveries (compared to the four-acid digestion value) for most elements, but especially for the elements of concern - copper, nickel, and zinc. Other elements traditionally associated with the silicate or oxide minerals demonstrated low recoveries, especially titaniu

Open-File Report↗

Projected 21st century coastal flooding in the Southern California Bight. Part 2: Tools for assessing climate change-driven coastal hazards and socio-economic impacts

This paper is the second of two that describes the Coastal Storm Modeling System (CoSMoS) approach for quantifying physical hazards and socio-economic hazard exposure in coastal zones affected by sea-level rise and changing coastal storms. The modelling approach, presented in Part 1, downscales atmospheric global-scale projections to local scale coastal flood impacts by deterministically computing the combined hazards of sea-level rise, waves, storm surges, astronomic tides, fluvial discharges, and changes in shoreline positions. The method is demonstrated through an application to Southern California, United States, where the shoreline is a mix of bluffs, beaches, highly managed coastal communities, and infrastructure of high economic value. Results show that inclusion of 100-year projected coastal storms will increase flooding by 9–350% (an additional average 53.0 ± 16.0 km 2 ) in addition to a 25–500 cm sea-level rise. The greater flooding extents translate to a 55–110% increase in residential impact and a 40–90% increase in building replacement costs. To communicate hazards and ranges in socio-economic exposures to these hazards, a set of tools were collaboratively designed and tested with stakeholders and policy makers; these tools consist of two web-based mapping and analytic applications as well as virtual reality visualizations. To reach a larger audience and enhance usability of the data, outreach and engagement included workshop-style trainings for targeted end-users and innovative applications of the virtual reality visualizations.

California↗

Multiple methods for multiple futures: Integrating qualitative scenario planning and quantitative simulation modeling for natural resource decision making

Scenario planning helps managers incorporate climate change into their natural resource decision making through a structured “what-if” process of identifying key uncertainties and potential impacts and responses. Although qualitative scenarios, in which ecosystem responses to climate change are derived via expert opinion, often suffice for managers to begin addressing climate change in their planning, this approach may face limits in resolving the responses of complex systems to altered climate conditions. In addition, this approach may fall short of the scientific credibility managers often require to take actions that differ from current practice. Quantitative simulation modeling of ecosystem response to climate conditions and management actions can provide this credibility, but its utility is limited unless the modeling addresses the most impactful and management-relevant uncertainties and incorporates realistic management actions. We use a case study to compare and contrast management implications derived from qualitative scenario narratives and from scenarios supported by quantitative simulations. We then describe an analytical framework that refines the case study’s integrated approach in order to improve applicability of results to management decisions. The case study illustrates the value of an integrated approach for identifying counterintuitive system dynamics, refining understanding of complex relationships, clarifying the magnitude and timing of changes, identifying and checking the validity of assumptions about resource responses to climate, and refining management directions. Our proposed analytical framework retains qualitative scenario planning as a core element because its participatory approach builds understanding for both managers and scientists, lays the groundwork to focus quantitative simulations on key system dynamics, and clarifies the challenges that subsequent decision making must address.

Climate Risk Management↗

Hydrologic Drought Decision Support System (HyDroDSS)

The hydrologic drought decision support system (HyDroDSS) was developed by the U.S. Geological Survey (USGS) in cooperation with the Rhode Island Water Resources Board (RIWRB) for use in the analysis of hydrologic variables that may indicate the risk for streamflows to be below user-defined flow targets at a designated site of interest, which is defined herein as data-collection site on a stream that may be adversely affected by pumping. Hydrologic drought is defined for this study as a period of lower than normal streamflows caused by precipitation deficits and (or) water withdrawals. The HyDroDSS is designed to provide water managers with risk-based information for balancing water-supply needs and aquatic-habitat protection goals to mitigate potential effects of hydrologic drought. This report describes the theory and methods for retrospective streamflow-depletion analysis, rank correlation analysis, and drought-projection analysis. All three methods are designed to inform decisions made by drought steering committees and decisionmakers on the basis of quantitative risk assessment. All three methods use estimates of unaltered streamflow, which is the measured or modeled flow without major withdrawals or discharges, to approximate a natural low-flow regime. Retrospective streamflow-depletion analysis can be used by water-resource managers to evaluate relations between withdrawal plans and the potential effects of withdrawal plans on streams at one or more sites of interest in an area. Retrospective streamflow-depletion analysis indicates the historical risk of being below user-defined flow targets if different pumping plans were implemented for the period of record. Retrospective streamflow-depletion analysis also indicates the risk for creating hydrologic drought conditions caused by use of a pumping plan. Retrospective streamflow-depletion analysis is done by calculating the net streamflow depletions from withdrawals and discharges and applying these depletions to a simulated record of unaltered streamflow. Rank correlation analysis in the HyDroDSS indicates the persistence of hydrologic measurements from month to month for the prediction of developing hydrologic drought conditions and quantitatively indicates which hydrologic variables may be used to indicate the onset of hydrologic drought conditions. Rank correlation analysis also indicates the potential use of each variable for estimating the monthly minimum unaltered flow at a site of interest for use in the drought-projection analysis. Rank correlation analysis in the HyDroDSS is done by calculating Spearman’s rho for paired samples and the 95-percent confidence limits of this rho value. Rank correlation analysis can be done by using precipitation, groundwater levels, measured streamflows, and estimated unaltered streamflows. Serial correlation analysis, which indicates relations between current and future values, can be done for a single site. Cross correlation analysis, which indicates relations among current values at one site and current and future values at a second site, also can be done. Drought-projection analysis in the HyDroDSS indicates the risk for being in a hydrologic drought condition during the current month and the five following months with and without pumping. Drought-projection analysis also indicates the potential effectiveness of water-conservation methods for mitigating the effect of withdrawals in the coming months on the basis of the amount of depletion caused by different pumping plans and on the risk of unaltered flows being below streamflow targets. Drought-projection analysis in the HyDroDSS is done with Monte Carlo methods by using the position analysis method. In this method the initial value of estimated unaltered streamflows is calculated by correlation to a measured hydrologic variable (monthly precipitation, groundwater levels, or streamflows from an index station identified with the rank correlation analysis). Then a pseudorandom number generator is used to create 251 six-month-long flow traces by using a bootstrap method. Serial correlation of the estimated unaltered monthly minimum streamflows determined from the rank correlation analysis is preserved within each flow trace. The sample of unaltered streamflows indicates the risk of being below flow targets in the coming months under simulated natural conditions (without historic withdrawals). The streamflow-depletion algorithms are then used to estimate risks of flow being below targets if selected pumping plans are used. This report also describes the implementation of the HyDroDSS. The HyDroDSS was developed as a Microsoft Access® database application to facilitate storage, handling, and use of hydrologic datasets with a simple graphical user interface. The program is implemented in the database by using the Visual Basic for Applications® (VBA) programming language. Program source code for the analytical techniques is provided in the HyDroDSS and in electronic text files accompanying this report. Program source code for the graphical user interface and for data-handling code, which is specific to Microsoft Access® and the HyDroDSS, is provided in the database. An installation package with a run-time version of the software is available with this report for potential users who do not have a compatible copy of Microsoft Access®. Administrative rights are needed to install this version of the HyDroDSS. A case study, to demonstrate the use of HyDroDSS and interpretation of results for a site of interest, is detailed for the USGS streamgage on the Hunt River (station 01117000) near East Greenwich in central Rhode Island. The Hunt River streamgage was used because it has a long record of streamflow and is in a well-studied basin with a substantial amount of hydrologic and water-use data including groundwater pumping for municipal water supply.

Rhode Island↗

Accelerated solvent extraction followed by on-line solid-phase extraction coupled to ion trap LC/MS/MS for analysis of benzalkonium chlorides in sediment samples

Benzalkonium chlorides (BACs) were successfully extracted from sediment samples using a new methodology based on accelerated solvent extraction (ASE) followed by an on-line cleanup step. The BACs were detected by liquid chromatography/ion trap mass spectrometry (LC/MS) or tandem mass spectrometry (MS/MS) using an electrospray interface operated in the positive ion mode. This methodology combines the high efficiency of extraction provided by a pressurized fluid and the high sensitivity offered by the ion trap MS/MS. The effects of solvent type and ASE operational variables, such as temperature and pressure, were evaluated. After optimization, a mixture of acetonitrile/water (6:4 or 7:3) was found to be most efficient for extracting BACs from the sediment samples. Extraction recoveries ranged from 95 to 105% for C12 and C14 homologues, respectively. Total method recoveries from fortified sediment samples, using a cleanup step followed by ASE, were 85% for C12BAC and 79% for C14-BAC. The methodology developed in this work provides detection limits in the subnanogram per gram range. Concentrations of BAC homologues ranged from 22 to 206 ??g/kg in sediment samples from different river sites downstream from wastewater treatment plants. The high affinity of BACs for soil suggests that BACs preferentially concentrate in sediment rather than in water.

Analytical Chemistry↗

Indirect spectrophotometric determination of traces of bromide in water

A rapid, accurate, and sensitive indirect spectrophotometric method for the determination of bromide in natural waters is based on the catalytic effect of bromide on the oxidation of iodine to iodate by potassium permanganate in sulfuric acid solution. The method is applicable to concentrations ranging from 1 to 100 μ g. of bromide per liter, but may be modified to extend the concentration range. Most ions commonly occurring in water do not interfere. The standard deviation is 2.9 at bromide concentrations of 100 μ g. per liter and less at lower concentrations. The determination of bromide in samples containing known added amounts gave values ranging from 99 to 105% of the concentration calculated to be present.

Analytical Chemistry↗

A decision-analytical framework for developing harvest regulations

The development of harvest regulations for fish or wildlife is a complex decision that needs to weigh multiple objectives, consider a set of alternative regulatory options, integrate scientific understanding about the population dynamics of the harvested species as well as the human response to regulations, account for uncertainty, and provide an avenue for feedback from monitoring programs. The author describes how the field of decision analysis provides a framework for structuring such decisions and tools for navigating the components. At the center of any harvest management endeavor is a set of objectives that may include providing harvest opportunity, conserving the harvested population long into the future, and satisfying hunters, anglers, or trappers; tools from multi-criteria decision analysis are useful in finding the right balance among competing objectives. The population dynamics of harvested populations are often stochastic; tools from risk analysis and dynamic optimization can be used to find state-dependent policies that manage variation. Finally, harvest regulations are often set in the face of uncertainty; value-of-information methods can be used to evaluate the importance of that uncertainty, and adaptive management methods can be used to reduce it.

Book chapter↗

Mapping ancient sedimentary organic matter molecular structure at nanoscales using optical photothermal infrared spectroscopy

Elucidating the molecular structure of sedimentary organic matter (SOM) is key to understanding petroleum generation processes, as well as ancient sedimentary environments. SOM structure is primarily controlled by biogenic source material (e.g., marine vs. terrigenous), depositional conditions, and subsurface thermal history. Additional factors, e.g., strain, may also impact the molecular structure of SOM. Multiple spatially resolved approaches exist for in situ evaluation of SOM, including Raman and infrared spectroscopies, as well as mass spectrometric methods. While these methods have enabled increased understanding of the occurrence and distribution of SOM functional groups, they suffer from disadvantages including low spatial resolution (infrared spectroscopy), limited molecular information (Raman spectroscopy), and sample destruction (mass spectrometric methods). Recent technological advances have resulted in infrared spectrometers capable of breaking the Abbe diffraction limit, greatly increasing the spatial resolutions accessible for an infrared measurement. Here we utilize optical photothermal infrared spectroscopy (O-PTIR) to record maps of functional group distributions at 500 nm spatial resolution in Tasmanites (algal microfossils) from the Upper Devonian Ohio Shale. These data allow for discrimination between Tasmanites , adjacent SOM, and fine-grained minerals. Additionally, functional group distributions within Tasmanites were found to be generally homogenous, although slight variations exist between the body and fold apices (zones of greatest deformation) which may indicate strain-induced chemical reactions. The data presented here represent the first application of O-PTIR to study SOM, highlighting the promise of this analytical approach for future studies evaluating the molecular composition of geologic materials at sub-micron scales.

Organic Geochemistry↗