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Results for “Journal of Chemical Physics”

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At least 55 records · Page 3Linked to original sources
USGS2008

In situ Raman spectroscopic investigation of the structure of subduction-zone fluids

In situ Raman spectra of synthetic subduction-zone fluids (KAlSi3O8-H2O system) were measured to 900?? and 2.3 GPa using a hydrothermal diamond-anvil cell. The structures of aqueous fluid and hydrous melt become closer when conditions approach the second critical endpoint. Almost no three-dimensional network was observed in the supercritical fluid above 2 GPa although a large amount of silicate component is dissolved, suggesting that the physical and chemical properties of these phases change drastically at around the second critical endpoint. Our experimental results indicate that the fluids released from a subducting slab change from aqueous fluid to supercritical fluid with increasing depth under the volcanic arcs. Copyright 2008 by the American Geophysical Union.

Journal of Geophysical Research B: Solid Earth↗
USGS1953

Rodent repellent studies. IV. Preparation and properties of trinitrobenzene-aryl amine complexes

Data are presented on methods of preparation, chemical and physical characteristics, toxicity, and repellency to rodents of complexes of symmetrical trinitrobenzene with various aromatic amines. When applied in suitable carriers or incorporated in plastic films, members of this series of materials were shown to offer significant increases in time required by wild rodents to damage common packaging materials.

Journal of the American Pharmaceutical Association↗
USGS1976

The source of hydrothermal solutions at Puerto Maunabo and its bearing on the base-metal-potassium feldspar association in Puerto Rico

A quartz oligoclase porphyry exposed near Puerto Maunabo may provide evidence to further our understanding of the base-metal-potassium feldspar association known to occur in many of the porphyry-type copper deposits of Puerto Rico. The porphyry appears to be a magmatic differentiate on the border of the San Lorenzo batholith that may represent a source of mineralizing hydrothermal solutions. The porphyry intrudes an albitized quartz diorite border phase of the batholith that contains large roof pendants of metavolcanic rock. These roof pendants are mostly metamorphosed to greenschist metamorphic facies, but in the vicinity of Puerto Maunabo south of the porphyry, they reach amphibolite metamorphic facies; north of the porphyry, similar xenolithic lenses of metavolcanic rock appear to have been converted entirely to an oligoclase quartz felsite. The layered albitized quartz felsite has the same composition and texture as irregular veinlets in the albitized quartz diorite and as the groundmass in the porphyry. The K + ions arid basic ions of Fe +2 , Cu +2 , Mg +2 apparently were mobilized during final magmatic crystallization and then escaped as hydrothermal solutions that followed open conduits within a zone of structural weakness which also permitted the emplacement of the porphyry. The volcanic rock of Cerro Piedra Hueca, in contact with the albitized quartz diorite, and generally along strike west of the porphyry, has been altered to a quartz sericite rock entirely devoid of mafic silicates. This is the southeasternmost exposure of hydrothermally altered volcanic rock in the regional zone of northwest-trending faults that contains the principal porphyry-type copper deposits of Puerto Rico. The texture, mineralogy, and geologic environment of the porphyry at Puerto Maunabo are similar to those of the ore-bearing porphyries but differ in one important aspect. Most ore-bearing porphyries contain hydrothermal potassium feldspar and reddish-brown biotite intimately associated with the base-metal sulfides. In the porphyry of Puerto Maunabo, potassium feldspar is conspicuously absent, and only a trace of biotite is present; the only sulfide present is pyrite. The physical and chemical environment required to precipitate K + ions, either as potassium feldspar or biotite, apparently is very similar to that required to precipitate base-metal sulfides. At Puerto Maunabo, these conditions evidently did not prevail, and potassium and the base metals may have been carried in solution to a more favorable environment.

Puerto Maunabo↗
USGS1983

delta18O variations in the Halimeda of Virgin Islands sands: evidence of cool water in the northeast Caribbean, late Holocene

Halimeda segments from carbonate sands on the Virgin Islands platform have delta 18 O versus PDB isotopic values ranging from -0.3% to -1.3% (x = -0.9%). Modern Halimeda segments from the same area have a measured delta 18 O ranging from -2.0% to -2.5% PDB (x = -2.15%), and the carbonate skeleton appears to have formed in isotopic equilibrium with the oceanic waters on the platform. Biologic and geochemical data indicate that the sand deposits have accumulated under physical and chemical conditions similar to the modern shelf environment. 14 C data suggest that the sand was deposited over an approximate 5800-year span, centering about 4000 years B.P. The average isotopic difference of 1.25% between the Holocene and modern carbonate indicates that the late Holocene Halimeda lived in waters approximately 4 degrees cooler than the present.

Virgin Islands↗
USGS2018

UZIG research: Measurement and characterization of unsaturated zone processes under wide-ranging climates and changing conditions

Unsaturated zone properties and processes are central to understanding the interacting effects of land-use change, contamination, and hydroclimate on our ability to grow food, sustain clean water supplies, and minimize loss of life and property. Advances in unsaturated zone science are being achieved through collaborations across traditional boundaries where information from biological, physical, and chemical disciplines is combined for new insights. The Unsaturated Zone Interest Group (UZIG) is an organization that exists principally to promote multidisciplinary collaborations and the sharing of ideas, expertise, and technical assets. Here we summarize key findings from 14 papers, several of which originated from a meeting convened by UZIG in 2017 at the University of Florida in Gainesville titled “Land-Use Change, Climate Change, and Hydrologic Extremes: Unsaturated Zone Responses and Feedbacks.” This special section of Vadose Zone Journal contains multidisciplinary research in three general categories relevant to measuring and understanding unsaturated zone responses to changing land uses and climate: (i) unsaturated zone properties and processes; (ii) soil–plant–atmosphere interactions; and (iii) novel field sampling devices. A strong cross-cutting theme in these papers is the value of continuous monitoring data and ways of utilizing them to discover novel hydrologic, biologic, and pedologic information. As climatic and land-use conditions change and demands for resources and stresses on ecosystems continue to intensify, it is vital to improve our fundamental understanding of the processes at work in the unsaturated zone. Toward that goal, we discuss the need for improved ground-based unsaturated zone monitoring networks.

Vadose Zone Journal↗
USGS1993

The erosion of carbonate stone by acid rain: Laboratory and field investigations

One of the goals of research on the effects of acidic deposition on carbonate stone surfaces is to define the incremental impact of acidic deposition relative to natural weathering processes on the rate of carbonate stone erosion. If rain that impacts carbonate stone surfaces is resident on the surface long enough to approach chemical equilibrium, the incremental effect of hydrogen ion is expected to be small (i.e., 6% for a rain of pH 4.0). Under nonequilibrium (i.e., high flow rate) conditions, kinetic considerations suggest that the incremental effect of hydrogen ion deposition could be quite significant. Field run-off experiments involving the chemical analysis of rain collected from inclined stone slabs have been used to evaluate stone dissolution processes under ambient conditions of wet and dry deposition of acidic species. The stoichiometry of the reaction of stone with hydrogen ion is difficult to define from the field data due to scatter in the data attributed to hydrodynamic effects. Laboratory run-off experiments show that the stoichiometry is best defined by a reaction with H+ in which CO2 is released from the system. The baseline effect caused by water in equilibrium with atmospheric CO2 is identical in the field and in laboratory simulation. The experiments show that the solutions are close enough to equilibrium for the incremental effect of hydrogen ion to be minor (i.e., 24% for marble for a rain of pH 4.0) relative to dissolution due to water and carbonic acid reactions. Stone erosion rates based on physical measurement are approximately double the recession rates that are due to dissolution (estimated from the observed calcium content of the run-off solutions). The difference may reflect the loss of granular material not included in recession estimates based on the run-off data. Neither the field nor the laboratory run-off experiments indicate a pH dependence for the grain-removal process.

Journal of Chemical Education↗
USGS2006

Description, Properties, and Degradation of Selected Volatile Organic Compounds Detected in Ground Water--A Review of Selected Literature

This report provides abridged information describing the most salient properties and biodegradation of 27 chlorinated volatile organic compounds detected during ground-water studies in the United States. This information is condensed from an extensive list of reports, papers, and literature published by the U.S. Government, various State governments, and peer-reviewed journals. The list includes literature reviews, compilations, and summaries describing volatile organic compounds in ground water. This report cross-references common names and synonyms associated with volatile organic compounds with the naming conventions supported by the International Union of Pure and Applied Chemistry. In addition, the report describes basic physical characteristics of those compounds such as Henry's Law constant, water solubility, density, octanol-water partition (log Kow), and organic carbon partition (log Koc) coefficients. Descriptions and illustrations are provided for natural and laboratory biodegradation rates, chemical by-products, and degradation pathways.

Open-File Report↗
USGS1994

The effect of a confining unit on the geochemical evolution of ground water in the Upper Floridan aquifer system

In west-central Florida, sections of the Upper Floridan aquifer system range in character from confined to leaky to unconfined. The confining unit is the Hawthorn Formation, a clay-rich sequence. The presence or absence of the Hawthorn Formation affects the geochemical evolution of the ground water in the Upper Floridan aquifer system. Mass-balance and mass-transfer models suggest that, in unconfined areas, the geochemical reactions are dolomite dissolution, ion exchange (Mg for Na, K), sulfate reduction, calcite dissolution, and CO 2 exchange. In the areas in which the Hawthorn Formation is leaky, the evolution of the ground water is accounted for by ion exchange, sulfate reduction, calcite dissolution, and CO 2 exchange. In the confined areas, no ion exchange and only limited sulfate reduction occur, and the chemical character of the ground water is consistent with dolomite and gypsum dissolution, calcite precipitation, and CO 2 ingassing. The Hawthorn Formation acts both as a physical barrier to the transport of CO 2 and organic matter and as a source of ion-exchange sites, but the carbonate-mineral reactions are largely unaffected by the extent of confinement of the Upper Floridan aquifer.

Journal of Hydrology↗
USGS1973

The chemistry of five accessory rock-forming apatites

Chemical and physical data are given for five samples of rock-forming apatite from diverse geologic environments in Nevada and Colorado. Four of these apatites contain rare-earth assemblages in which the cerium group is well represented but the yttrium group predominates. The fifth apatite contains a highly fractionated assemblage of the lighter (cerium group) rare earths similar to the assemblage typical of alkulic rocks.

Nevada, Colorado↗
USGS1973

Problems of underground storage of wastes

Problems of underground storage of waste involve geology in its broadest sense, including hydrology, geochemistry, and geophysics. Wastes may be solid, liquid, or gaseous, and they may be chemically toxic or noxious, esthetically offensive, or radioactive. Some wastes require only temporary containment, whereas others must be isolated for indefinitely long periods. The means and locale for emplacement underground depend upon many governing geological factors, including the physical, chemical, hydrological, and hydraulic properties of the host formation. These must be studied relative to the physical, chemical, and thermal properties of the waste and of potential interactions between the waste and the host formation. Thorough knowledge is essential because lack of it may lead to undesirable or disastrous environmental consequences. Escape of waste may contaminate the surface or near-surface environment; it may destroy the usefulness or accessibility of resources such as ground water, petroleum, and minerals. Effective management of underground waste requires adaptation of current technology and development of new technology.

Journal of Research of the U.S. Geological Survey↗
USGS1990

Modelling streamwater chemistry as a mixture of soilwater end-members - An application to the Panola Mountain catchment, Georgia, U.S.A.

Streamwater chemistry at Panola Mountain research catchment, Georgia, U.S.A., is explained as a mixture of representative soilwater solutions that are considered to be temporally invariant to a first approximation. The selection of three end-members from all sampled soil waters is evaluated by comparing the observed and predicted streamwater concentration of six solutes (alkalinity, sulfate, sodium, magnesium, calcium and dissolved silica), which are assumed to mix conservatively, and by assessing the consistency of the implied hydrograph separation with the hydrological mechanisms that are believed to be operating in this catchment. The percentage of variation in the streamwater solute concentrations explained by the end-member mixing analysis (EMMA) ranges from 82 to >97%, and the hydrograph separation is, intuitively, physically reasonable. If the correct end-members have been identified, the streamwater chemical response to different levels of acidic deposition can be predicted by examining the change in each end-member under different loads; no hydrological model is required. If a traditional hydrochemical model, which is driven by rainfall quantity and quality, is desired, this analysis provides an indication of the model structure that would be necessary to reproduce both streamwater and soilwater chemistry.

Georgia↗
USGS2012

Persistence of soil organic matter in eroding versus depositional landform positions

Soil organic matter (SOM) processes in dynamic landscapes are strongly influenced by soil erosion and sedimentation. We determined the contribution of physical isolation of organic matter (OM) inside aggregates, chemical interaction of OM with soil minerals, and molecular structure of SOM in controlling storage and persistence of SOM in different types of eroding and depositional landform positions. By combining density fractionation with elemental and spectroscopic analyses, we showed that SOM in depositional settings is less transformed and better preserved than SOM in eroding landform positions. However, which environmental factors exert primary control on storage and persistence of SOM depended on the nature of the landform position considered. In an annual grassland watershed, protection of SOM by physical isolation inside aggregates and chemical association of organic matter (complexation) with soil minerals, as assessed by correlation with radiocarbon concentration, were more effective in the poorly drained, lowest-lying depositional landform positions, compared to well-drained landform positions in the upper parts of the watershed. Results of this study demonstrated that processes of soil erosion and deposition are important mechanisms of long-term OM stabilization.

Journal of Geophysical Research: Biogeosciences↗
USGS2019

A brief introduction to integrated pest management for aquatic systems

Aquatic invasive plants and animals are increasingly becoming a problem, causing severe economic and ecological damage to critical freshwater systems. The best strategy for controlling an invasive pest employs an integrated pest management (IPM) approach using a combination of biological, physical, chemical, and social/cultural control methods. Here, we examine the history and development of IPM and provide a discussion of the components of an IPM program involving development, evaluation, and management. Control approaches will be reviewed and the application of this technique to aquatic systems will be discussed. A discussion of the Great Lakes Fishery Commission's (GLFC) Integrated Management of Sea Lamprey Petromyzon marinus Control Program will be provided to illustrate the application of IPM to an aquatic system.

North American Journal of Fisheries Management↗
USGS2007

Potential effects of climate change on surface-water quality in North America

Data from long-term ecosystem monitoring and research stations in North America and results of simulations made with interpretive models indicate that changes in climate (precipitation and temperature) can have a significant effect on the quality of surface waters. Changes in water quality during storms, snowmelt, and periods of elevated air temperature or drought can cause conditions that exceed thresholds of ecosystem tolerance and, thus, lead to water-quality degradation. If warming and changes in available moisture occur, water-quality changes will likely first occur during episodes of climate-induced stress, and in ecosystems where the factors controlling water quality are sensitive to climate variability. Continued climate stress would increase the frequency with which ecosystem thresholds are exceeded and thus lead to chronic water-quality changes. Management strategies in a warmer climate will therefore be needed that are based on local ecological thresholds rather than annual median condition. Changes in land use alter biological, physical, and chemical processes in watersheds and thus significantly alter the quality of adjacent surface waters; these direct human-caused changes complicate the interpretation of water-quality changes resulting from changes in climate, and can be both mitigated and exacerbated by climate change. A rigorous strategy for integrated, long-term monitoring of the ecological and human factors that control water quality is necessary to differentiate between actual and perceived climate effects, and to track the effectiveness of our environmental policies.

Journal of the American Water Resources Associatio↗
USGS2013

Biochar effect on maize yield and soil characteristics in five conservation farming sites in Zambia

Biochar addition to agricultural soils can improve soil fertility, with the added bonus of climate change mitigation through carbon sequestration. Conservation farming (CF) is precision farming, often combining minimum tillage, crop rotation and residue retention. In the present farmer-led field trials carried out in Zambia, the use of a low dosage biochar combined with CF minimum tillage was tested as a way to increase crop yields. Using CF minimum tillage allows the biochar to be applied to the area where most of the plant roots are present and mirrors the fertilizer application in CF practices. The CF practice used comprised manually hoe-dug planting 10-L sized basins, where 10%–12% of the land was tilled. Pilot trials were performed with maize cob biochar and wood biochar on five soils with variable physical/chemical characteristics. At a dosage as low as 4 tons/ha, both biochars had a strong positive effect on maize yields in the coarse white aeolian sand of Kaoma, West-Zambia, with yields of 444% ± 114% ( p = 0.06) and 352% ± 139% ( p = 0.1) of the fertilized reference plots for maize and wood biochar, respectively. Thus for sandy acidic soils, CF and biochar amendment can be a promising combination for increasing harvest yield. Moderate but non-significant effects on yields were observed for maize and wood biochar in a red sandy clay loam ultisol east of Lusaka, central Zambia (University of Zambia, UNZA, site) with growth of 142% ± 42% ( p > 0.2) and 131% ± 62% ( p > 0.2) of fertilized reference plots, respectively. For three other soils (acidic and neutral clay loams and silty clay with variable cation exchange capacity, CEC), no significant effects on maize yields were observed ( p > 0.2). In laboratory trials, 5% of the two biochars were added to the soil samples in order to study the effect of the biochar on physical and chemical soil characteristics. The large increase in crop yield in Kaoma soil was tentatively explained by a combination of an increased base saturation (from <50% to 60%–100%) and cation exchange capacity (CEC; from 2–3 to 5–9 cmol/kg) and increased plant-available water (from 17% to 21%) as well as water vapor uptake (70 mg/g on maize cob biochar at 50% relative humidity).

Agronomy Journal↗
USGS2002

Adaptive moving mesh methods for simulating one-dimensional groundwater problems with sharp moving fronts

Accurate modelling of groundwater flow and transport with sharp moving fronts often involves high computational cost, when a fixed/uniform mesh is used. In this paper, we investigate the modelling of groundwater problems using a particular adaptive mesh method called the moving mesh partial differential equation approach. With this approach, the mesh is dynamically relocated through a partial differential equation to capture the evolving sharp fronts with a relatively small number of grid points. The mesh movement and physical system modelling are realized by solving the mesh movement and physical partial differential equations alternately. The method is applied to the modelling of a range of groundwater problems, including advection dominated chemical transport and reaction, non-linear infiltration in soil, and the coupling of density dependent flow and transport. Numerical results demonstrate that sharp moving fronts can be accurately and efficiently captured by the moving mesh approach. Also addressed are important implementation strategies, e.g. the construction of the monitor function based on the interpolation error, control of mesh concentration, and two-layer mesh movement. Copyright ?? 2002 John Wiley and Sons, Ltd.

International Journal for Numerical Methods in Eng↗
USGS2020

Timescales and processes of methane hydrate formation and breakdown, with application to geologic systems

Gas hydrate is an ice-like form of water and low molecular weight gas stable at temperatures of roughly -10ºC to 25ºC and pressures of ~3 to 30 MPa in geologic systems. Natural gas hydrates sequester an estimated one-sixth of Earth’s methane and are found primarily in deepwater marine sediments on continental margins, but also in permafrost areas and under continental ice sheets. When gas hydrate is removed from its stability field, its breakdown has implications for the global carbon cycle, ocean chemistry, marine geohazards, and interactions between the geosphere and the ocean-atmosphere system. Gas hydrate breakdown can also be artificially driven as a component of studies assessing the resource potential of these deposits. Furthermore, geologic processes and perturbations to the ocean-atmosphere system (e.g., warming temperatures) can cause not only dissociation, but also more widespread dissolution of hydrate or even formation of new hydrate in reservoirs. Linkages between gas hydrate and disparate aspects of Earth’s near-surface physical, chemical, and biological systems render an assessment of the rates and processes affecting the persistence of gas hydrate an appropriate Centennial Grand Challenge. This paper reviews the thermodynamic controls on methane hydrate stability and then describes the relative importance of kinetic, mass transfer, and heat transfer processes in the formation and breakdown (dissociation and dissolution) of gas hydrate. Results from numerical modeling, laboratory, and some fields studies are used to summarize the rates of hydrate formation and breakdown, followed by an extensive treatment of hydrate dynamics in marine and cryospheric gas hydrate systems.

Journal of Geophysical Research-Solid Earth↗
USGS2000

Defining anural malformations in the context of a developmental problem

This paper summarizes terminology and general concepts involved in animal development for the purpose of providing background for the study and understanding of frog malformations. The results of our radiographic investigation of rear limb malformations in Rana pipiens provide evidence that frog malformations are the product of early developmental errors. Although bacteria, parasites and viruses were identified in these metamorphosed frogs, the relevant window to look for the teratogenic effect of these agents is in the early tadpole stage during limb development. As a result, our microbiological findings must be regarded as inconclusive relative to determining their contribution to malformations because we conducted our examinations on metamorphosed frogs not tadpoles. Future studies need to look at teratogenic agents (chemical, microbial, physical or mechanical) that are present in the embryo, tadpole, and their environments at the stages of development that are relevant for the malformation type. The impact of these teratogenic agents then needs to be assessed in appropriate animal models using studies that are designed to mimic field conditions. The results of these laboratory tests should then be analyzed in such a way that will allow comparison with the findings in the wild-caught tadpoles and frogs.

Journal of the Iowa Academy of Science↗