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制冷剂替代物相平衡性质的分子动力学模拟 总被引:1,自引:0,他引:1
本文利用分子动力学模拟算法研究制冷剂替代物的气液相平衡性质。通过将制冷剂替代物作为极性的2CLJ流体处理,建立了针对它们的 2CLJD 势能模型。利用 NPT+Test Particle 算法对五种制冷剂替代物 (HFC-152a,HFC-143a,HFC-134a,HCFC-142b和HFC-227ea)的气液相平衡性质进行了计算,同时验证了计算结果的热力学一致性。模拟结果与 NIST 的 REFPROP 数据库的最大相对偏差在2%以内。 相似文献
43.
Novel extracellular polymeric substances produced by Cupriavidus necator IPT 027 grown on glucose and crude glycerol originated from biodiesel
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The aim of this study was to evaluate the production and properties of novel extracellular polymeric substances (EPS) from glucose (EPS 1) and crude glycerol (CG) from castor beans oil (EPS 2). Cupriavidus necator IPT 027 cultivated with glucose and CG (35 °C, 150 rpm, 72 hr, pH 7, shaker) produced approximately 1.60 ± 0.01 and 2.83 ± 0.02 g l?1 EPS, respectively, with high‐molecular weight (3.89 × 105 and 1.89 × 107 Da) and constituted of different functional groups such as uronic acid, monosaccharides (glucose, mannose, arabinose, and fucose) and primary amine group. The composition of the fermentable substrate influenced the melting temperature (221.11 and 230.18 °C), crystallinity (34.36% and 37.11%), degradation temperature (255.06 and 296.62 °C) and morphology. EPS showed pseudoplastic non‐Newtonian fluid behavior in the aqueous solutions, presenting potential applicability biotechnological and industrial mainly in food industry as emulsifiers and biosurfactants. This is the first study on the production and characterization of EPS obtained by C. necator IPT 027 in culture with glucose and CG. Copyright © 2016 John Wiley & Sons, Ltd. 相似文献
44.
基于格林函数理论,主要利用Lerray-Schauder抉择定理和上下解方法针对半正定条件下,奇异超线性二阶周期边值问题正解的存在性进行推理证明,获取了奇异超线性二阶周期边值问题的一个正解. 相似文献
45.
In this paper we prove Phragmén-Lindelöf type alternative for the initial boundary problem of Stokes equation, i. e. we show that the energy expression for the solution of the initial boundary problem must either grow exponentially or decay exponentially with axial distance from the end of a semi-infinite strip. For the case of decay, we also establish the pointwise estimate for the maximum module of the Stokes flow and present a method for obtaining explicit bounds for the total energy.Project supported by the National Natural Science Foundation of China and Zhongshan University Science Foundation 相似文献
46.
A new nonlinear evolution equation is derived for surface solitary waves propagating on a liquid-air interface where the wave motion is induced by a harmonic forcing. Instead of the traditional approach involving a base state of the long wave limit, a base state of harmonic waves is assumed for the perturbation analysis. This approach is considered to be more appropriate for channels of length just a few multiples of the depth. The dispersion relation found approaches the classical long wave limit. The weakly nonlinear dispersive waves satisfy a KdV-like nonlinear evolution equation with steeper nonlinearity. 相似文献
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In this note we investigate the generalized Hyers-Ulam-Rassias stability for the new cubic type functional equation f(x+y+2z)+f(x+y−2z)+f(2x)+f(2y)=2[f(x+y)+2f(x+z)+2f(x−z)+2f(y+z)+2f(y−z)] by using the fixed point alternative. The first systematic study of fixed point theorems in nonlinear analysis is due to G. Isac and Th.M. Rassias [Internat. J. Math. Math. Sci. 19 (1996) 219-228]. 相似文献
49.
A number of new fixed-point results are presented for S-KKM self maps. Also the notion of essentiality for S-KKM maps is introduced. 相似文献
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