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51.
Clint N. Dawson 《国际流体数值方法杂志》1990,11(6):835-847
The immiscible displacement problem in reservoir engineering can be formulated as a system of partial differential equations which includes an elliptic pressure–velocity equation and a degenerate parabolic saturation equation. We apply a sequential numerical scheme to this problem where time splitting is used to solve the saturation equation. In this procedure one approximates advection by a higher-order Godunov method and diffusion by a mixed finite element method. Numerical results for this scheme applied to gas–oil centrifuge experiments are given. 相似文献
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Davydov R Osborne RL Shanmugam M Du J Dawson JH Hoffman BM 《Journal of the American Chemical Society》2010,132(42):14995-15004
Dehaloperoxidase (DHP) from Amphitrite ornata is a heme protein that can function both as a hemoglobin and as a peroxidase. This report describes the use of 77 K cryoreduction EPR/ENDOR techniques to study both functions of DHP. Cryoreduced oxyferrous [Fe(II)-O(2)] DHP exhibits two EPR signals characteristic of a peroxoferric [Fe(III)-O(2)(2-)] heme species, reflecting the presence of conformational substates in the oxyferrous precursor. (1)H ENDOR spectroscopy of the cryogenerated substates shows that H-bonding interactions between His N(ε)H and heme-bound O(2) in these conformers are similar to those in the β-chain of oxyferrous hemoglobin A (HbA) and oxyferrous myoglobin, respectively. Decay of cryogenerated peroxoferric heme DHP intermediates upon annealing at temperatures above 180 K is accompanied by the appearance of a new paramagnetic species with an axial EPR signal with g(⊥) = 3.75 and g(∥) = 1.96, characteristic of an S = 3/2 spin state. This species is assigned to Compound I (Cpd I), in which a porphyrin π-cation radical is ferromagnetically coupled with an S = 1 ferryl [Fe(IV)═O] ion. This species was also trapped by rapid freeze-quench of the ambient-temperature reaction mixture of ferric [Fe(III)] DHP and H(2)O(2). However, in the latter case Cpd I is reduced very rapidly by a nearby tyrosine to form Cpd ES [(Fe(IV)═O)(porphyrin)/Tyr(?)]. Addition of the substrate analogue 2,4,6-trifluorophenol (F(3)PhOH) suppresses formation of the Cpd I intermediate during annealing of cryoreduced oxyferrous DHP at 190 K but has no effect on the spectroscopic properties of the remaining cryoreduced oxyferrous DHP intermediates and kinetics of their decay. These observations indicate that substrate (i) binds to oxyferrous DHP outside of the distal pocket and (ii) can reduce Cpd I to Cpd II [Fe(IV)═O]. These assumptions are also supported by the observation that F(3)PhOH has only a small effect on the EPR properties of radiolytically cryooxidized and cryoreduced ferrous [Fe(II)] DHP. EPR spectra of cryoreduced ferrous DHP disclose the multiconformational nature of the ferrous DHP precursor. The observation and characterization of Cpds I, II, and ES in the absence and in the presence of F(3)PhOH provides definitive evidence of a mechanism involving consecutive one-electron steps and clarifies the role of all intermediates formed during turnover. 相似文献
56.
Graham Dawson Wei Chen Tiekai Zhang Zheng Chen Xiaorong Cheng 《Solid State Sciences》2010,12(12):2170-2176
Mixed phase TiO2 powders of different composition and particle size were subjected to the hydrothermal reaction with 10 M NaOH. It was found that the anatase phase component of the starting material is easily converted to trititanate nanotubes at 140 °C. At this temperature the rutile phase remains unreacted, however at 170 °C it reacts to form trititanate plates and belts. When the reaction time is increased to 7 days, all the TiO2 is converted to trititanate and the morphology is exclusively nanoplates and belts, with the tube phase destroyed. Many researchers have observed some heterogeneity in their reaction products, but have mainly focussed on the nanotubes. We observed that the tubes are only prepared from the anatase phase component of a TiO2 precursor, whereas the rutile component produces trititanate plates and sheets, irrespective of the reaction length. The particle size affects the rate of reaction, resulting in the phase transition being more easily visible in the reactions starting with the larger TiO2 particle size. 相似文献
57.
C. Michoski C. Mirabito C. Dawson D. Wirasaet E.J. Kubatko J.J. Westerink 《Journal of computational physics》2011,230(22):8028-8056
We study a family of generalized slope limiters in two dimensions for Runge–Kutta discontinuous Galerkin (RKDG) solutions of advection-diffusion systems. We analyze the numerical behavior of these limiters applied to a pair of model problems, comparing the error of the approximate solutions, and discuss each limiter’s advantages and disadvantages. We then introduce a series of coupled p-enrichment schemes that may be used as standalone dynamic p-enrichment strategies, or may be augmented via any in the family of variable-in-p slope limiters presented. 相似文献
58.
Photomechanical actuation is demonstrated in two coupled liquid crystal elastomer photomechanical optical devices (PODs) acting in series. The response function of an individual POD is characterized and used to predict the temporal response of the coupled system. The predicted coupled-system response agrees with the experiment for several waveforms and frequencies, suggesting that large-scale integration of photomechanical devices is possible. 相似文献
59.
Margriet V. D. Z. Park Iseult Lynch Sonia Ram��rez-Garc��a Kenneth A. Dawson Liset de la Fonteyne Eric Gremmer Wout Slob Jacob J. Bried�� Andreas Elsaesser C. Vyvyan Howard Henk van Loveren Wim H. de Jong 《Journal of nanoparticle research》2011,13(12):6775-6787
The biological response to four well-characterized amorphous silica nanoparticles was investigated in RAW 264.7 macrophages in view of their potential application as drug carriers to sites of inflammation. All silica nanoparticles-induced cell membrane damage, reduced metabolic activity, generated ROS and released various cytokines, but to different extents. Two silica nanoparticles of 34 nm (A and B) with different zetapotentials were more cytotoxic than (aggregated) 11 and 248 nm nanoparticles, while cytokines were mostly induced by the (aggregated) 11 nm and only one of the 34 nm nanoparticles (34A). The results indicate that specific silica nanoparticles may have counterproductive effects, for example when used as carriers of anti-inflammatory drugs. The physicochemical properties determining the response of nanoparticles vary for different responses, implying that a screening approach for the safe development of nanoparticles needs to consider the role of combinations of (dynamic) physicochemical properties and needs to include multiple toxicity endpoints. 相似文献
60.
Z. Gong Y. F. Zhang P. Kelm I. M. Watson E. Gu M. D. Dawson 《Applied Physics A: Materials Science & Processing》2011,103(2):389-393
We present the fabrication details and performance characteristics of InGaN light-emitting diodes (LEDs) consisting of arrays
of interconnected micro-pixels where each micro-pixel is nano-textured via nano-imprinting. We have taken the further step
of embodying the pixels in a rhomboidal geometry. It is found that the power output of these nano-textured micro-LEDs with
rhomboidal geometries is 57% higher than that of conventional square-shaped broad-area reference LEDs. The series resistance
of the textured LEDs is reduced, owing to the multi-finger electrodes introduced. Furthermore, these LEDs can sustain higher
operation current of up to 500 mA without encapsulation, suggesting improved thermal dissipation capability. Finally, the
combined effects of surface texturing, micro-LED configuration, and geometric shaping on the light extraction are analyzed.
It is found that the power enhancement by surface texturing, micro-pixellating and the rhomboidal geometry are 32%, 16%, and
9%, respectively, implying that surface texturing is the most effective contribution to increasing the light extraction efficiency
in our design. The angular dependent far-field beam profile is also remarkably changed, compared with the standard Lambertian
emission pattern of the conventional square-shaped LEDs. Substantial increase in the EL intensity is evident from both the
top surface and the sidewall. 相似文献