745 research outputs found
Ion Based Pressure Sensor for Pulse Detonation Engines
A high speed, durable, ion probe based pressure sensor is being investigated for use in pulse detonation engines. Traditional pressure sensors are ill suited for the high temperature and vibratory environment encountered in such engines. An alternative transient pressure sensing method is investigated for pressures behind a hydrocarbon flame. These flames generate ions that are quenched by collisions as a function of pressure. An experiment was devised to correlate the ion decay rate with the pressure using an ion probe well suited for the flow. A correlation has been established showing the ion decay rate is a function of pressure. Additional investigation is required even though the ion probe remains a viable alternative method for measuring pressure
Vertebrate Reservoirs of Arboviruses : Myth, Synonym of Amplifier, or Reality?
The rapid succession of the pandemic of arbovirus diseases, such as dengue, West Nile fever, chikungunya, and Zika fever, has intensified research on these and other arbovirus diseases worldwide. Investigating the unique mode of vector-borne transmission requires a clear understanding of the roles of vertebrates. One major obstacle to this understanding is the ambiguity of the arbovirus definition originally established by the World Health Organization. The paucity of pertinent information on arbovirus transmission at the time contributed to the notion that vertebrates played the role of reservoir in the arbovirus transmission cycle. Because this notion is a salient feature of the arbovirus definition, it is important to reexamine its validity. This review addresses controversial issues concerning vertebrate reservoirs and their role in arbovirus persistence in nature, examines the genesis of the problem from a historical perspective, discusses various unresolved issues from multiple points of view, assesses the present status of the notion in light of current knowledge, and provides options for a solution to resolve the issue.Peer reviewe
Role of Polarons in Single-Atom Catalysts: Case Study of Me1 [Au1, Pt1, and Rh1] on TiO2(110)
The local environment of metal-oxide supported single-atom catalysts plays a decisive role in the surface reactivity and related catalytic properties. The study of such systems is complicated by the presence of point defects on the surface, which are often associated with the localization of excess charge in the form of polarons. This can affect the stability, the electronic configuration, and the local geometry of the adsorbed adatoms. In this work, through the use of density functional theory and surface-sensitive experiments, we study the adsorption of Rh-1, Pt-1, and Au-1 metals on the reduced TiO2(110) surface, a prototypical polaronic material. A systematic analysis of the adsorption configurations and oxidation states of the adsorbed metals reveals different types of couplings between adsorbates and polarons. As confirmed by scanning tunneling microscopy measurements, the favored Pt-1 and Au-1 adsorption at oxygen vacancy sites is associated with a strong electronic charge transfer from polaronic states to adatom orbitals, which results in a reduction of the adsorbed metal. In contrast, the Rh-1 adatoms interact weakly with the excess charge, which leaves the polarons largely unaffected. Our results show that an accurate understanding of the properties of single-atom catalysts on oxide surfaces requires a careful account of the interplay between adatoms, vacancy sites, and polarons
Electrochemical evidence of catalysis of oxygen reduction at the polarized liquid–liquid interface by tetraphenylporphyrin monoacid and diacid
Cyclic voltammetry is used to study the role of 5,10,15,20-tetraphenyl-21H,23H-porphine (H2TPP) in the reduction of molecular oxygen by decamethylferrocene (DMFc) at the polarized water|1,2-dichloroethane (DCE) interface. It is shown that this rather slow reaction proceeds remarkably faster in the presence of tetraphenylporphyrin monoacid (H3TPP+) and diacid (H4TPP2+), which are formed in DCE by the successive transfer of two protons from the acidified aqueous phase. A mechanism is proposed, which includes the formation of adduct between H3TPP+ or H4TPP2+ and O2 that is followed by electron transfer from DMFc to the adduct leading to the observed production of DMFc+ and to the regeneration of H2TPP or H3TPP+, respectively
Surface chemistry on a polarizable surface: Coupling of CO with KTaO3(001)
Polarizable materials attract attention in catalysis because they have a free parameter for tuning chemical reactivity. Their surfaces entangle the dielectric polarization with surface polarity, excess charge, and orbital hybridization. How this affects individual adsorbed molecules is shown for the incipient ferroelectric perovskite KTaO3. This intrinsically polar material cleaves along (001) into KO- and TaO2-terminated surface domains. At TaO2 terraces, the polarity-compensating excess electrons form a two-dimensional electron gas and can also localize by coupling to ferroelectric distortions. TaO2 terraces host two distinct types of CO molecules, adsorbed at equivalent lattice sites but charged differently as seen in atomic force microscopy/scanning tunneling microscopy. Temperature-programmed desorption shows substantially stronger binding of the charged CO; in density functional theory calculations, the excess charge favors a bipolaronic configuration coupled to the CO. These results pinpoint how adsorption states couple to ferroelectric polarization
CO oxidation by Pt2/Fe3O4: Metastable dimer and support configurations facilitate lattice oxygen extraction
Heterogeneous catalysts based on subnanometer metal clusters often exhibit strongly size-dependent properties, and the addition or removal of a single atom can make all the difference. Identifying the most active species and deciphering the reaction mechanism is extremely difficult, however, because it is often not clear how the catalyst evolves in operando. Here, we use a combination of atomically resolved scanning probe microscopies, spectroscopic techniques, and density functional theory (DFT)-based calculations to study CO oxidation by a model Pt/Fe3O4(001) "single-atom" catalyst. We demonstrate that (PtCO)(2) dimers, formed dynamically through the agglomeration of mobile Pt-carbonyl species, catalyze a reaction involving the oxide support to form CO2. Pt-2 dimers produce one CO2 molecule before falling apart into two adatoms, releasing the second CO. Olattice extraction only becomes facile when both the Pt-dimer and the Fe3O4 support can access metastable configurations, suggesting that substantial, concerted rearrangements of both cluster and support must be considered for reactions occurring at elevated temperature
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A Data Parallel Finite Element Method for Computational Fluid Dynamics on the Connection Machine System
A finite element method for computational the Connection Machine systems CM-2 and CM-200. An implicit iterative solution strate-
gy, based on the preconditioned matrix-free GMRES algorithm, is employed. Parallel data structures built on both nodal and elemental sets are used to achieve maximum parallelization. Communication primitives provided through the Connection Machine Scientific Software Library substantially improved the overall performance of the program. Computations of three-dimensional compressible flows using unstructured meshes having close to one million elements, such as a complete airplane, demonstrate that the Connection Machine systems are suitable for these applications. Performance comparisons are also carried out with the vector computers Cray Y-MP and Convex C-1.Engineering and Applied Science
Restoration of Nusinersen Levels Following Treatment Interruption in People With Spinal Muscular Atrophy: Simulations Based on a Population Pharmacokinetic Model
Background: Nusinersen is approved for the treatment of spinal muscular atrophy. The most common approved dosing regimen is four intrathecal loading doses of nusinersen 12 mg; the first three are administered at 14-day intervals followed by a fourth dose 30 days later, and then 12-mg maintenance doses are administered every 4 months thereafter. Interruption of nusinersen treatment in the maintenance dosing phase might occur for a number of clinical reasons. /
Objective: The objective of this report is to describe dosing regimens that allow for the most rapid restoration of steady-state concentrations of nusinersen in the cerebrospinal fluid (CSF) following a treatment interruption during maintenance dosing. /
Methods: Population pharmacokinetic models using integrated pharmacokinetic data from ten nusinersen clinical trials that included a broad range of participants with spinal muscular atrophy treated with intrathecal nusinersen were used to investigate different durations of treatment interruptions during maintenance treatment. Potential dosing regimens for re-initiation of nusinersen were evaluated, with the goal of achieving the quickest restoration of steady-state nusinersen CSF concentrations without exceeding maximal CSF exposures observed during the initial loading period. /
Results: Our pharmacokinetic modeling indicates the following regimen will lead to optimal restoration of nusinersen CSF levels after treatment interruption: two doses of nusinersen should be administered at 14-day intervals following treatment interruptions of ≥ 8 to < 16 months since the last dose, and three doses of nusinersen at 14-day intervals for treatment interruptions of ≥ 16 to < 40 months since the last maintenance dose, with subsequent maintenance dosing every 4 months in both instances. After treatment interruptions of ≥ 40 months, the full loading regimen will rapidly restore nusinersen CSF levels. /
Conclusions: Prolonged treatment interruptions lead to suboptimal CSF levels of nusinersen. The optimal regimen to restore nusinersen CSF levels depends on the interval since the last maintenance dose was administered
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Mesh Decomposition and Communication Procedures for Finite Element Applications on the Connection Machine CM-5 System
The objective of this paper is to analyze the impact of data mapping strategies on the performance of finite element applications. First, we describe a parallel mesh decomposition algorithm based on recursive spectral bisection used to partition the mesh into element blocks. A simple heuristic algorithm then renumbers the mesh nodes. Large three-dimensional meshes demonstrate the efficiency of those mapping strategies and assess the performance of a finite element program for fluid dynamics.Engineering and Applied Science
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