不可逆量子斯特林热泵循环性能分析与优化

建立了以一维无限深势阱中极端相对论粒子为工质的不可逆量子斯特林热泵循环模型。考虑高低温热源之间的热漏,导出了循环的性能系数与无量纲泵热率的表达式。分析了循环性能与各性能参数之间的关系。研究发现,热泵的性能系数与无量纲泵热率都随粒子在状态1进处于激收态上的占有几度单调递减,性能系数与无量纲泵热率都是势阱宽度比的凸单调函数。无量纲泵热率关于性能系数的关系曲线为回原点的扭叶型,并确定了该不可逆量子斯特林热泵的最优运行区间。     

热力学函数关系图示法

通过多年教学实践，归纳出热力学函数间基本关系式的图示法。该图示法手法简捷，便于记忆和运用。     

First-principles Investigation of the Structural,Electronic and Elastic Properties of Al2Ca and Al4Sr Phases in Mg-Al-Ca（Sr） Alloy

First-principles calculations have been carried out to investigate the structural stabilities, electronic structures and elastic properties of Mg17Al12, Al2Ca and Al4Sr phases. The optimized structural parameters are in good agreement with the experimental and other theoretical values. The calculated formation enthalpies and cohesive energies show that Al2Ca has the strongest alloying ability, and Al4Sr has the highest structural stability. The densities of states （DOS）, Mulliken electronic populations, and electronic charge density difference are obtained to reveal the underlying mechanism of structural stability. The bulk modulus, shear modulus, Young＇s modulus, and Poisson＇s ratio are estimated from the calculated elastic constants. The mechanical properties of these phases are further analyzed and discussed. The Gibbs free energy and Debye temperature are also calculated and discussed.     

制冷系统隐性故障分析

制冷系统中,隐性故障因故障现象不是十分明显而难以及时被发现,致使系统带故运行,造成能源的浪费。从热力学角度分析了制冷系统极易发生的5种隐性故障,总结出5种隐性故障的压力、温度变化特征,提供了判断隐性故障的途径。     

Analytical attractive functions and their derivatives in bulk and nanoconfined pores

In this paper, two new analytical attractive (alpha) functions and their derivatives in bulk and nanoconfined pores are developed based on the virial equation of state (EOS) and statistical thermodynamics and are evaluated at different conditions for the first time. A cubic EOS is modified to nanometer scale and applied to predict the thermodynamic and phase properties in bulk and nanoconfined pores coupled with the new analytical alpha functions. The nanoscale-extended EOS coupled with the analytical alpha functions are validated to be accurate by means of the experimental data for the thermodynamic and phase calculations. The alpha functions and dimensionless attractive term A for the O₂, Ar, CO₂, N₂, and C₁-C₁₀ are always positive and monotonically decrease with the temperature increases at T ≤ 2000 K in the bulk phase, whereas the second virial coefficients (B₂) are always negative and increase with the temperature increases. Moreover, the alpha functions, A, and B₂ for all of components remain constant with the decreasing pore radius until r_p = 50 nm, the former two of which decrease while the latter one increases by further reducing the pore radius. It should be noted that the intermolecular attractive force (ie, A) is a function of the pressure, which is gradually increased at P ≤ 10 MPa though drastically increases afterwards. Also, the enhanced confinement effects lead the same-component intermolecular attractive forces to be smaller. The analytical formulations in the SRK type slightly outperform in the gaseous or light component cases, while those in the PR type are better for the heavy component cases in terms of the thermodynamic property calculations, both of which are compatible with the modified EOS and analytical alpha functions.     

换热器热力学分析实例与节能途径

本文对换热器进行了热力学分析,找出了其能耗高的主要环节是换热过程不可逆因素引起的?损失,为改进设备和节能提供了途径.     

一种推出熵函数和热力学温标的新方法

本文从热力学第二定律的克劳修斯说法出发,并结合开尔文说法,推出了克劳修斯不等式.本文还得到了∮δQr/θ=0的充要条件(θ为温标未定时的温度,Qr为可逆热),并由此自然地引出了熵函数及热力学温标.     

High‐throughput and comprehensive prediction of H2 adsorption in metal‐organic frameworks under various conditions

High‐throughput prediction of H₂ adsorption in metal‐organic framework (MOF) materials has been extended from a few specific conditions to the whole T, p space. The prediction is based on a classical density functional theory and has been implemented over 712 MOFs in 441 different conditions covering a wide range. Some testing materials show excellent behavior at low temperatures and obvious improvement at high temperatures compared to conventional MOFs. The structures of the best MOFs at high and low temperatures are totally different. Linear and nonlinear correlations between the two Langmuir parameters have been found at high and low temperatures, respectively. According to the analysis of the excess uptake, we found that the saturated pressure increases along with temperature in the low temperature region but decreases in the high temperature region. © 2015 American Institute of Chemical Engineers AIChE J, 61: 2951–2957, 2015     

Upgrading of low-grade manganese ore based on reduction roasting and magnetic separation technique

The selective reduction of low-grade manganese ore followed by magnetic separation was proposed to produce rich-manganese ore. The optimized parameters include a roasting temperature of 1050°C, a roasting time of 6 h, a manganese ore size of 8–13 mm, and an FC/O ratio of 2.5. The reduction roasting products of low-grade manganese ore, mainly comprising of MnO, metallic iron, and residual gangue, could be separated effectively to obtain rich-manganese ore and magnetic product. The RMn, RFe, and TMn can reach the peak values of 71.00%, 93.60%, and 56.20wt%, respectively, at a rational magnetic field strength of 100 mT. In particular, the Mn/Fe ratio is up to 10.85, which meets the requirements of ferromanganese alloy smelting.