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We investigate the hydrodynamic boundary condition for simple nanofluidic systems such as argon and methane flowing in graphene nanochannels using equilibrium molecular dynamics simulations (EMD) in conjunction with our recently proposed method [J. S. Hansen, B. D. Todd, and P. J. Daivis, Phys. Rev. E 84, 016313 (2011)]. We first calculate the fluid-graphene interfacial friction coefficient, from which we can predict the slip length and the average velocity of the first fluid layer close to the wall (referred to as the slip velocity). Using direct nonequilibrium molecular dynamics simulations (NEMD) we then calculate the slip length and slip velocity from the streaming velocity profiles in Poiseuille and Couette flows. The slip lengths and slip velocities from the NEMD simulations are found to be in excellent agreement with our EMD predictions. Our EMD method therefore enables one to directly calculate this intrinsic friction coefficient between fluid and solid and the slip length for a given fluid and solid, which is otherwise tedious to calculate using direct NEMD simulations at low pressure gradients or shear rates. The advantages of the EMD method over the NEMD method to calculate the slip lengths/flow rates for nanofluidic systems are discussed, and we finally examine the dynamic behaviour of slip due to an externally applied field and shear rate. 相似文献
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SHA. Hashemi Kachapi Rao V. Dukkipati S.Gh. Hashemi K. S.Mey. Hashemi K. S.Meh. Hashemi K. SK. Hashemi K. 《Nonlinear Analysis: Real World Applications》2010,11(3):1431-1441
An analytical approach is developed for areas of nonlinear science such as the nonlinear free vibration of a conservative, two-degree-of-freedom mass–spring system having linear and nonlinear stiffnesses. The main contribution of this research is twofold. First, it introduces the transformation of two nonlinear differential equations for a two-mass system using suitable intermediate variables into a single nonlinear differential equation and, more significantly, the treatment of a nonlinear differential system by linearization coupled with Newton’s method. Secondly, the major section is the solving of the governing nonlinear differential equation where the displacement of the two-mass system can be obtained directly from the linear second-order differential equation using a first-order variational approach. The aforementioned approach proposed by J.H. He, who actually developed the method, is exactly He’s variational method. This approach is an explicit method with high validity for resolving strong nonlinear oscillation system problems. Two examples of nonlinear two-degree-of-freedom mass–spring systems are analyzed, and verified with published results and exact solutions. The method can be easily extended to other nonlinear oscillations and so could be widely applicable in engineering and science. 相似文献
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SK Hussain Balla Putrakumar Ponnala Bhanuchander Ginjupalli Srinivasarao Nekkala Nagaraju Koppadi Kumara Swamy Komandur V R Chary 《Catalysis Surveys from Asia》2022,26(2):104-114
Catalysis Surveys from Asia - Catalytic production of ethyl levulinate by alcoholysis of furfuryl alcohol with ethanol was investigated over H-mordenite supported Sn catalyst under atmospheric N2... 相似文献
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Jack SK Chang Carolyn Chang Min Shi 《The Journal of the Operational Research Society》2015,66(3):405-420
We propose a novel market-based approach to optimum inventory control in a doubly stochastic jump-diffusion economy by modelling a commodity distributor’s inventory investment as a portfolio of forward commitments with explicit accounting of the jump-diffusion dynamics of demands, costs, and prices in open markets. We apply the robust real-asset martingale valuation methodology to derive a closed-form solution for the inventory value and a simple and intuitive optimality condition. Numerical analysis verifies this condition and demonstrates that the resulting optimum policy has robust properties in relation to the stylized effects. 相似文献
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Sharbari Palmal SK Basiruddin Amit Ranjan Maity Dr. Sekhar C. Ray Dr. Nikhil R. Jana 《Chemistry (Weinheim an der Bergstrasse, Germany)》2013,19(3):943-949
Fluorescent gold clusters (FGCs) with tunable emission from blue to red and quantum yields in the range of 6–17 % have been synthesized by simple modification of the conditions used for the synthesis of gold nanoparticles, namely by replacing the stronger reducing agent with a controlled amount of thiol. Various functional FGCs with hydrodynamic diameters of 5–12 nm have been successfully synthesized and used as cell labels. The results of our investigations strongly indicate that FGCs composed of Au0 are more stable imaging probes than commonly reported red/NIR‐emitting FGCs with a composition of Au0/AuI, as this combination rapidly transforms into nonfluorescent large clusters on exposure to light. The FGC‐based nanoprobes reported herein exhibit stable fluorescence upon continuous light exposure and can be used as imaging probes with low cytotoxicity. 相似文献
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Alcohol ethoxylates (AEs) are nonionic surfactants. They are industrially important compounds that have historically been difficult to analyze, with the best results to date achieved through derivatization (e.g., silylation) followed by analysis by gas chromatography/mass spectrometry (GC/MS). Recently, mass spectrometric techniques such as field desorption (FD), time-of-flight secondary ion mass spectrometry (TOF-SIMS), fast atom bombardment (FAB), electrospray ionization (ESI) and matrix-assisted laser desorption/ionization (MALDI) have been employed to analyze surfynol(R) 4xx. In an effort to produce low-cost alkyl-capped AEs and anionic detergents from AEs, a fast and reliable measure of the product yields and conversions from AEs is required in research. We found that the product yields and conversions from reactions of AEs, obtained by the employment of atmospheric pressure chemical ionization (APCI), were in good agreement with those obtained from proton nuclear magnetic resonance spectroscopy ((1)H-NMR). Therefore, APCI can be used as a validated tool for studying AE reactions. Mixtures that contain either silylated or unsilylated ethoxylates and/or carboxylates yield the same APCI mass spectra. Copyright -Copyright 1999 John Wiley & Sons, Ltd. 相似文献
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Ki Hwan Bae 《中国化学快报》2009,20(11):1321-1323
Phytochemical study on the BuOH-soluble fraction of the stem bark of Populus davidiana resulted in the isolation of a new salicin derivative(1),named davidianoside.The structure was elucidated on the basis of extensive physicochemical and spectroscopic analyses. 相似文献
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S Rayaprol Krushna Mavani CM Thaker DS Rana Keka Chakravorty SK Paranjape M Ramanadham Nilesh A Kulkarni DG Kuberkar 《Pramana》2002,58(5-6):877-880
A new series of mixed oxide superconductors with the stoichiometric composition La2−x
Dy
x
Ca
y
Ba2Cu4+y
O
z
(x=0.0 − 0.5, y=2x) has been studied for structural and superconductiong properties. Our earlier studies on La2−x
(Y/Er)
x
Ca
y
Ba2Cu4+y
O
z
series, show a strong dependence of T
c on hole concentration (p
sh). In the present work, the results of the analysis of the neutron diffraction measurements at room temprerature on x=0.3 and 0.5 samples are reported. It is interesting to know that Ca substitutes for both La and Ba site with concomitant
displacement of La onto Ba site. Superconductivity studies show that maximum T
c is obtained for x=0.5, y=1.0 sample (T
c ∼ 75 K), for La1.5Dy0.5Ca1Ba2Cu5O
z
(La-2125). 相似文献