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Perspectives on Microfluidics for the Study of Asphaltenes in Upstream Hydrocarbon Production: A Minireview
The utilization of microfluidics has generated deep insights into asphaltene precipitation mechanisms and oil–water emulsion stabilization. Agglomeration and precipitation of asphaltenes can cause flow assurance problems during the extraction and transportation of crude oil. Change in temperature, pressure, reservoir conditions, and solvents can change the local environment, leading to asphaltene precipitation. Understanding asphaltene properties and precipitation pathways becomes critical in devising mitigation methods, demulsifiers, and suitable conditions during hydrocarbon processing. Microfluidics has helped in high throughput measurement studies, understanding critical processing conditions, fast demulsifier screening, and the effect of solvent concentration on deposition, generating useful information for utilization at the point of resource extraction facilitating improved resource management. It has become possible to capture the porous, complex nature of reservoir formations and the interaction of chemicals during precipitation through integrated analytics and visualization studies available only through microfluidics. The use of droplet microfluidics, with optical microscopy and high-speed imaging to study the oil–water interface, has resulted in greater understanding of the role of asphaltenes in interfacial properties and emulsion stabilization. Here, this minireview highlights the crucial aspects of microfluidics that have been used to understand physicochemical behavior and dynamics of asphaltene deposition. Some of the unique devices have been presented focusing on the key elements of microfluidics design, fabrication, and analysis, as the insight obtained from microfluidics strongly depends on the device design and the controllability of the experimental parameters. Successful implementation of microfluidics for efficient and controlled experiments, short analysis time scales and rapid screening, and generation of high-quality, reliable data that convey asphaltene deposition issues and interface behavior in emulsions shows the importance of microsystems for advancing knowledge in hydrocarbon production and processing.
Unsaturated Sulfur Crown Ethers Can Extract Mercury(II) and Show Promise for Future Copernicium(II) Studies: A Combined Experimental and Computational Study
The unsaturated hexathia-18-crown-6 (UHT18C6) molecule was investigated for the extraction of Hg(II) in HCl and HNO3 media. This extractant can be directly compared to the recently studied saturated hexathia-18-crown-6 (HT18C6). The default conformation of the S lone pairs in UHT18C6 is endodentate, where the pocket of the charge density, according to the crystal structures, is oriented toward the center of the ring, which should allow better extraction for Hg(II) compared to the exodentate HT18C6. Batch study experiments showed that Hg(II) had better extraction at low acid molarity (ca. 99% in HCl and ca. 95% in HNO 3 ), while almost no extraction was observed above 0.4 M HCl and 4 M HNO 3 (<5%). Speciation studies were conducted with the goal of delineating a plausible extraction mechanism. Density functional theory calculations including relativistic effects were carried out on both Hg(II)-encapsulated HT18C6 and UHT18C6 complexes to shed light on the binding strength and the nature of bonding. Our calculations offer insights into the extraction mechanism. In addition to Hg(II), calculations were performed on the hypothetical divalent Cn(II) ion, and showed that HT18C6 and UHT18C6 could extract Cn(II). Finally, the extraction kinetics were explored to assess whether this crown can extract the short-lived Cn(II) species in a future online experiment.
Adsorption Properties of Au−Ni Surface Alloys with a Nonstoichiometric Moiré Structure: A Density Functional Theory Study
Due to the large lattice mismatch between gold and nickel, gold–nickel surface alloys can form unique nonstoichiometric overlayer structures characterized by a moiré pattern and subsurface defects. For this work, we performed density functional theory (DFT) calculations to study the adsorption of molecular oxygen, atomic hydrogen, and atomic carbon on a gold–nickel(111) surface alloy with 0.46 monolayer gold randomly distributed in the surface layer. We observed six distinct adsorption structures for molecular oxygen characterized by intramolecular stretching frequencies of <700, 729, 795, 857, 929, and 1004 cm –1 , which describe well the experimentally observed high-resolution electron energy-loss spectra. Surface atomic hydrogen adsorption is associated with adsorbate–surface modes in the ∼1000 cm –1 range, while subsurface hydrogen can have features as low as ∼400 cm –1 . We observed a unique adsorption structure for atomic carbon inside the surface dislocation loop defect, which explains the experimentally observed low carbon-surface mode at ∼340 cm –1 . Our study sheds light on the unique adsorption properties of the gold–nickel surface alloys and helps with rationalizing vibrational frequency experimental studies for this system.
First-Principles Study on the Role of Cu and Cl-Based Dopants in NiO
Utilization of wide band gap oxide-based materials in thin-film solar energy technologies has increased in recent years. Among the numerous candidate oxide materials, NiO has shown many desirable optoelectronic properties that are applicable to thin-film PV technologies such as cadmium telluride PV. However, one critical factor requiring further investigation is the p-type doping behavior of NiO, specifically when the cadmium telluride solar cell undergoes conventional processes such as copper doping and chlorine-based activation treatment. The previous literature has shown a large degree of variability in hole concentrations in NiO when copper is used as the primary dopant. This study uses first-principles computational modeling based on density functional theory coupled with defect equilibria calculations to quantitatively explore the role of copper and chlorine-based extrinsic dopants in the p-type doping activity of NiO. The study reveals the importance of extrinsic dopants and their binding interactions with nickel vacancies to effectively p-dope NiO. It is suggested that both the formation of V Ni + Cu Ni and V Ni + Cl O defect pairs under a supersaturated state of NiO are potential mechanisms for increasing hole densities. On the other hand, the production of 2Cu Ni severely limits the effectiveness of p-doping in NiO, even in the presence of the aforementioned defect pairs. Furthermore, the study provides a guideline for experimentalists interested in using copper or chlorine species to understand how to controllably p-dope NiO during thin-film synthesis.
Report of the 2021 U.S. Community Study on the Future of Particle Physics (Snowmass 2021)
In 2019, with the construction of the projects supported by the 2014 P5 process well underway or in an advanced stage of planning, the Division of Particle and Fields (DPF) of the American Physical Society (APS) began to prepare a new community study of U.S. high energy physics (HEP) for the decade of 2025 – 2035, and beyond. This “Snowmass 2021” HEP Community Planning Exercise began formally with a kick-off meeting at the 2020 APS April Meeting and a Community-wide Planning Meeting in October of 2020. The exercise was to conclude in July of 2021 with a workshop in Seattle hosted by the University of Washington. The COVID-19 pandemic severely disrupted these plans. Work was paused from January to September of 2021 to lighten the burden on our younger scientists. We resumed work by September of 2021 and, despite the continuing challenges of COVID-19, our community was well prepared for the Seattle meeting, which had been rescheduled for July 17–26, 2022.
DSO+T: Expanded Study Results DSO+T Study: Volume 5
The Distribution System Operator with Transactive (DSO+T) study investigates the engineering and economic performance of a transactive energy retail market coordinating a high penetration of customer-side flexible energy assets. The study seeks to answer whether such an implementation is cost effective for customers, recovers sufficient revenue for DSOs, and is equally applicable and beneficial to a range of flexible asset types, renewable generation scenarios, and market assumptions. This report volume provides a detailed set of results for the DSO+T study extending results presented in Volumes 1, 2, and 4. The engineering and economic performance of the transactive energy scheme is presented for two separate flexible asset deployments: flexible loads (HVAC units and residential water heaters) and behind-the-meter batteries. The results of each transactive case are compared to a business-as-usual case. These cases are subject to two different renewable generation scenarios, a moderate renewable generation scenario, representative of current levels of renewable generation deployment, and a future high renewables scenario, including the increased deployment of rooftop solar photovoltaic and electric vehicles. The transactive coordination scheme is shown to produce effective and stable control and decrease peak loads 9–15%. The resulting annual demand flexibility provides net economic savings of $3.3–5.0B per year for a region the size of Texas. Detailed analysis shows that net benefits were seen for a range of distribution system operator, customer, and flexible asset types. Both participating customer (with transactive flexible assets) and nonparticipating customers (with nonflexible assets) see reductions in annual utility bills and net annual energy expenses in the range of 10–16%.
Lunar Flight Study Series: Volume 6. A Study of Geometrical and Terminal Characteristics of Earth-Moon Transits Embedded in the Earth-Moon Plane
This report represents the results of a study of coplanar earth-moon transits. The study was initiated to provide information concerning coplanar geometrical characteristics of earth-moon trnasits. The geometrical aspects of transit behavior are related to variations injection conditions. The model of the earth-moon system used in this investigation is the Jacobian model of the restricted three body problem. All transits considered in this study are restricted to the moon-earth plane (MEP).
Hypersonic Research Facilities Study - Volume III, Part 2: Phase II Parametric Studies Flight Vehicle Synthesis
Airbreathing hypersonic aircraft employing liquid hydrogen fuel have the potential of satisfying a number of mission requirements in the 1980-2000 time period. However, major advances in the technological state of the art are necessary before such aircraft can be considered either feasible or practical. The objective was to assess the research and development requirements for hypersonic aircraft and based on these requirements, to provide the NASA with characteristics of a number of desirable hypersonic research facilities. The study is organized in three phases. Phase I was a preliminary analysis of a broad group of concepts which were reduced to seven flight research facilities and eleven ground research facilities for Phase II study. The purpose of Phase II was to perform parametric studies to refine the facility designs and obtain sensitivity information in the neighborhood of "near optimum" designs, and to select those facilities that appear most attractive in the sense of research potential vs cost for further refinement in Phase III. This part of Volume III presents the results of the synthesis of the flight research facilities.
A study of LC-39 cryogenic systems. Part 1: A study of the vacuum insulated transfer lines at Kennedy Space Center. Part 2: Cooldown pressure surges
The vacuum liquid hydrogen and liquid oxygen transfer lines at Kennedy Space Center were studied to evaluate the feasibility of using a condensing gas such as CO2 inside the vacuum spaces to achieve a condensing-vacuum. The study indicates that at ambient temperature, a maximum vacuum hyphen space pressure of 4000 microns is acceptable for the LH2 transfer lines. In addition, the cooldown procedures for the 14-inch cross-country liquid oxygen line was studied using a simplified mathematical model. Preliminary cooldown times are presented for various heat leak rates to the line and for two vent configurations.
Conceptual design studies of candidate V/STOL lift fan commercial short haul transport for 1980 - 1985 V/STOL lift fan study
Conceptual designs of V/STOL lift fan commercial short haul transport aircraft for the 1980-85 time period were studied to determine their technical and economic feasibility. The engine concepts included both integral and remote fans. The scope of the study included definition of the hover control concept for each propulsion system, aircraft design, aircraft mass properties, cruise performance, noise and ride qualities evaluation. Economic evaluating was also studied on a basis of direct operating costs and route structure.
Outer planet entry probe system study. Volume 4: Common Saturn/Uranus probe studies
Results are summarized of a common scientific probe study to explore the atmospheres of Saturn and Uranus. This was a three-month follow-on effort to the Outer Planet Entry Probe System study. The report presents: (1) a summary, conclusions and recommendations of this study, (2) parametric analysis conducted to support the two system definitions, (3) common Saturn/Uranus probe system definition using the Science Advisory Group's exploratory payload and, (4) common Saturn/Uranus probe system definition using an expanded science complement. Each of the probe system definitions consists of detailed discussions of the mission, science, system and subsystems including telecommunications, data handling, power, pyrotechnics, attitude control, structures, propulsion, thermal control and probe-to-spacecraft integration. References are made to the contents of the first three volumes where it is feasible to do so.
Life sciences payload definition and integration study, task C and D. Volume 2: Payload definition, integration, and planning studies
The Life Sciences Payload Definition and Integration Study was composed of four major tasks. Tasks A and B, the laboratory definition phase, were the subject of prior NASA study. The laboratory definition phase included the establishment of research functions, equipment definitions, and conceptual baseline laboratory designs. These baseline laboratories were designated as Maxi-Nom, Mini-30, and Mini-7. The outputs of Tasks A and B were used by the NASA Life Sciences Payload Integration Team to establish guidelines for Tasks C and D, the laboratory integration phase of the study. A brief review of Tasks A and B is presented provide background continuity. The tasks C and D effort is the subject of this report. The Task C effort stressed the integration of the NASA selected laboratory designs with the shuttle sortie module. The Task D effort updated and developed costs that could be used by NASA for preliminary program planning.
Shuttle filter study. Volume 2: Contaminant generation and sensitivity studies
Contaminant generation studies were conducted at the component level using two different methods, radioactive tracer technique and gravimetric analysis test procedure. Both of these were reduced to practice during this program. In the first of these methods, radioactively tagged components typical of those used in spacecraft were studied to determine their contaminant generation characteristics under simulated operating conditions. Because the purpose of the work was: (1) to determine the types and quantities of contaminants generated; and (2) to evaluate improved monitoring and detection schemes, no attempt was made to evaluate or qualify specific components. The components used in this test program were therefore not flight hardware items. Some of them had been used in previous tests; some were obsolete; one was an experimental device. In addition to the component tests, various materials of interest to contaminant and filtration studies were irradiated and evaluated for use as autotracer materials. These included test dusts, plastics, valve seat materials, and bearing cage materials.
Spacelab user implementation assessment study (software requirements analysis). Volume 1: Executive study
The primary objective of this study was to develop an integrated approach for the development, implementation, and utilization of all software that is required to efficiently and cost-effectively support advanced technology laboratory flight and ground operations. It was recognized that certain aspects of the operations would be mandatory computerized services; computerization of other aspects would be optional. Thus, the analyses encompassed not only alternate computer utilization and implementations but trade studies of the programmatic effects of non-computerized versus computerized approaches to the operations. A general overview of the study is presented.
Orbit Transfer Vehicle Engine Study. Phase A, extension 1: Study plan update
The updated study plan for the Space Transportation System orbit transfer vehicle (OTV) engine study is presented. The study program consists of engine system, programmatic, cost, and risk analyses of OTV engine concepts. Detailed task descriptions for the advanced expander cycle engine optimization, alternate low thrust capability, and safety, reliability, and cost comparisons are given.
Extravehicular Crewman Work System (ECWS) study program: Prebreathe elimination study
The study examined impacts of changing Orbiter cabin pressure and EMU EVA pressure to eliminate pure O2 prebreathing prior to EVA. The investigation defines circumscribing physiological boundaries and identifies changes required within Orbiter to reduce cabin pressure. The study also identifies payload impacts, payload flight assignment constraints, and impacts upon EMU resulting from raising EVA pressure. The study presents the trade-off which optimizes the choice of reduced cabin pressure and increased EVA pressure.
Research study: Studies in atmospheric processes from Space Platforms
Activities of the project for studies in atmospheric processes from space platforms are described. Topics include feasibility studies for a Low Altitude Research Satellite system, a satellite borne Doppler lidar wind monitoring system, the relationship between solar variability and weather, atmospheric modeling, cloud physics, and aerosol studies.