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A simple approach to estimate the melting temperature of alkali halides 估算碱卤化物熔化温度的一种简单方法
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1213
M. Goyal
In the present study, a thermodynamical formulation is developed to determine the melting temperature of alkali halides with increasing pressure. The model is used to estimate the melting temperature of alkali halides at different pressures qualitatively. The formulation is obtained using the Goyal and Gupta thermodynamic equation of state. The model calculations require the computed values of volume compression, bulk modulus and its first pressure derivative at varying pressures. It is noted from model calculations that melting temperature increases with pressure but not in linear manner. The present computed results for pressure dependent melting temperature are compared with the available simulated results. The approach is found to be valid as good agreement is observed between previous and present results. Graphs are plotted to depict the variation of melting temperature with isothermal pressure, thermal pressure and total pressure acting on the solid. The present study helps to understand the impact of pressure on melting temperature of alkali halides qualitatively. The model used can also extrapolate the results upto higher pressures.
在本研究中,开发了一个热力学公式来确定碱卤化物随压力增加的熔化温度。利用该模型对碱卤化物在不同压力下的熔融温度进行了定性估计。利用Goyal和Gupta热力学状态方程得到了该公式。模型计算需要计算出不同压力下的体积压缩、体积模量及其一阶压力导数的值。从模型计算中可以看出,熔融温度随压力的增加而增加,但不是线性的。本文的计算结果与已有的模拟结果进行了比较。这种方法是有效的,因为以前的结果和现在的结果很一致。绘制了等温压力、热压和总压作用于固体时熔化温度的变化曲线。本研究有助于定性地了解压力对碱卤化物熔融温度的影响。所使用的模型还可以将结果外推到更高的压力。
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引用次数: 0
Thermophysical properties of biodiesel fuels from modified perturbed hard trimer chain equation of state 由改性扰动硬三聚体链状态方程研究生物柴油燃料的热物理性质
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1099
Negar Parvizi, F. Akbari, M. Alavianmehr, D. Mohammad-Aghaie
In the present study, a modified version of the perturbed hard trimer chain equation of state was employed to predict thermophysical properties of fatty acid methyl ester (FAME) and fatty acid ethyl ester (FAEE) systems. The thermophysical properties in question are liquid density, vapor pressure, heat capacity, viscosity and thermal conductivity. The predictive power of the model has been assessed by calculating the aforementioned thermophysical properties and comparing with experimental ones as well as other models. Typically, the overall average absolute relative deviation (AARD in %) of the predicted densities for 1665 data points was found to be 2.57%. Simplicity and good agreement between the experimental data and those calculated from the present model, are the reasons for applicability of proposed model with sufficient accuracy for engineering applications. The capability of this new equation of state in predicting both thermodynamic and transport properties simultaneously with good accuracies is really prominent.
本研究采用一种改进的微扰硬三聚链状态方程来预测脂肪酸甲酯(FAME)和脂肪酸乙酯(FAEE)体系的热物理性质。所讨论的热物理性质是液体密度、蒸汽压、热容、粘度和导热系数。通过计算上述热物性,并与实验值及其他模型进行比较,对模型的预测能力进行了评价。在典型情况下,对1665个数据点的预测密度的总体平均绝对相对偏差(AARD in %)为2.57%。该模型的计算结果与实验数据吻合较好,计算结果简单,具有较高的工程应用精度。这种新的状态方程能够同时准确地预测热力学和输运性质,这是非常突出的。
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引用次数: 0
Influence of contact pressure on the thermal contact conductance of layered metallic sheets 接触压力对层状金属板热传导的影响
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1107
T. Matsushita, I. Belov, A. Johansson, A. Jarfors
For the optimisation of the annealing process of aluminium coils, simulation of the process is often performed. To simulate the process with higher accuracy, reliable input parameters are required, and thermal conductivity (thermal contact conductance) is one of them. In the present study, a method to measure the thermal conductivity and thermal contact conductance of metallic sheets were developed based on the steady-state comparative longitudinal heat flow. The apparatus was built with a compression test machine, and thus it allows to control the pressure to the sample and carry out the measurements at different contact pressure. An equipped heater allows to heat the sample to 573 K. To evaluate the thermal conductance at the interface, a thermal resistance network model was applied. The measurements were carried out with an aluminium alloy (AA3003 sheets). In addition to the thermal contact conductance measurements, the surface roughness of the sheets was also investigated. The semi-empirical equation for the relationship between thermal contact conductance and contact pressure was obtained based on the measurement results.
为了优化铝卷的退火工艺,经常对该工艺进行模拟。为了更高的精度模拟过程,需要可靠的输入参数,热导率(热接触导率)就是其中之一。本文提出了一种基于稳态比较纵向热流的金属薄板热导率和接触热导率测量方法。该仪器配有压缩试验机,因此它可以控制样品的压力,并在不同的接触压力下进行测量。配备的加热器允许将样品加热到573 K。为了评估界面处的热导率,采用了热阻网络模型。测量是用铝合金(AA3003板材)进行的。除了热接触电导测量外,还研究了薄片的表面粗糙度。根据测量结果,得到了接触热导率与接触压力关系的半经验方程。
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引用次数: 3
Molar heat capacity of liquid Ti, Al20Ti80 and Al50Ti50 measured in electromagnetic levitation 电磁悬浮法测量液体Ti、Al20Ti80和Al50Ti50的摩尔热容
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1169
J. Brillo, J. Wessing, H. Kobatake, H. Fukuyama
Temperature dependent isobaric molar heat capacity cP was measured in a containerless way for liquid Ti and two AlTi binary liquid alloys. The technique of electromagnetic levitation was used in combination with laser modulation calorimetry. In all cases, linear temperature dependencies were found: At the corresponding liquidus temperatures, cP equals 49.75(±2.0) J∙K-1mol-1, 57.43(±2.9) J∙K-1mol-1, and 42.60(±2.2) J∙K-1mol-1, for Ti, Al20Ti80 and Al50Ti50, respectively. The respective temperature coefficients amount to -1.67∙10-2J∙K-2mol-1, -2.73∙10-2J∙K-2mol-1, and +7.83∙10-2J∙K-2mol-1. For liquid Ti, there is a good agreement with existing literature data. The results are discussed in relation to the Neumann-Kopp rule.
用无容器的方法测量了液体Ti和两种AlTi二元液体合金的温度依赖等压摩尔热容cP。将电磁悬浮技术与激光调制量热法相结合。在所有情况下,都发现了线性温度依赖性:在相应的液相温度下,Ti、Al20Ti80和Al50Ti50的cP分别为49.75(±2.0)J∙K-1mol-1、57.43(±2.9)J∙K-1mol-1和42.60(±2.2)J∙K-1mol-1。温度系数分别为-1.67∙10-2J∙K-2mol-1、-2.73∙10-2J∙K-2mol-1和+7.83∙10-2J∙K-2mol-1。对于液态Ti,与已有文献数据吻合较好。并结合Neumann-Kopp规则对结果进行了讨论。
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引用次数: 3
Thermo-mechanical characterization of carbon-based ceramic foams for high temperature space application 高温空间应用碳基泡沫陶瓷的热力学特性
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1003
M. Albano, A. Nenarokomov, R. Pastore, S. Budnik, A. Delfini, O. Alifanov, M. Marchetti, A. V. Morzhukhina, Dmitry M. Titov, F. Santoni, F. Piergentili, A. Netelev
The successful development of aerospace reusable launch vehicles (RLV) require to realize effective thermal protection systems (TPS) for preserving spacecraft integrity from the severe thermal loads during re-entry phase. To such an aim, due to the need of reducing payload transportation costs, applied research is driven towards lightweight materials with advanced thermo-mechanical properties. Space TPS are often based on sandwich structures, where the core material has the main function of thermal insulation. Ceramic porous materials, as carbon (C) and silicon carbide (SiC) foams, represent ideal candidates for application as structural TPS component, thanks to both low density and significant thermal stability at very high temperatures. The paper presents a joint experimental study of carbon-based ceramic foams proposed as sandwich’s core for TPS design. A full thermal characterization of commercial C- and SiC-foam materials is reported, including measurements of thermo-mechanical combined stress, temperature-induced outgassing behavior and heat transfer properties. These latter, in particular, are studied by means of a robust numerical technique, known as the inverse method, which allows to evaluate materials thermal conductivity and heat capacity over a wide range of temperatures, thus establishing the required material behavior for potential use in spacecraft TPS.
航天可重复使用运载火箭(RLV)的成功发展需要实现有效的热防护系统(TPS),以保护航天器在再入阶段的严重热载荷下的完整性。为此,由于降低有效载荷运输成本的需要,应用研究被推向具有先进热机械性能的轻质材料。空间TPS通常基于夹层结构,其中芯材具有隔热的主要功能。陶瓷多孔材料,如碳(C)和碳化硅(SiC)泡沫,由于其低密度和在高温下的显著热稳定性,代表了作为结构TPS组件的理想候选材料。本文对碳基陶瓷泡沫材料作为TPS设计的夹层芯进行了联合实验研究。本文报道了商用C和sic泡沫材料的完整热特性,包括热-机械组合应力、温度诱导出气行为和传热性能的测量。特别是后者,通过一种被称为逆方法的强大数值技术进行了研究,该技术允许在很宽的温度范围内评估材料的导热性和热容,从而确定了航天器TPS中潜在使用所需的材料行为。
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引用次数: 2
Modeling thermodynamic properties of Ni, Sn, Al and Cu nanosolids Ni, Sn, Al和Cu纳米固体的热力学性质建模
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1263
Madan Singh, B. Taele, S. Lara, S. Singhal, Kamal Devlal
Surface atoms and dangling bonds on the surface affect the thermodynamic properties. A thermodynamical model, based on cohesive energy is presented to discuss the melting properties of materials at nanoscale. The model is used to realize the effect of size and shape on melting temperature Tmn, melting entropy Smn and enthalpy Hmn of Ni, Sn, Al and Cu metallic nanoparticles. The variation in Tmn, Smn and Hmn are examined for nanowire, film, spherical, regular tetrahedral, hexahedral and octahedral shaped nanoparticles. It is reported that Tmn, Smn and Hmn decrease with decreasing the size of the nanoparticles and smaller the particle size, greater are the size and shape effects and when size is less than 10 nm, it has been predicted that on decreasing size, Tmn, Smn and Hmn reduce appreciably. Also, at the same size, more the shape of nanoparticles departs from that of the sphere, smaller is the Smn and Hmn of nanoparticles and its changes are less for nanowire shape and more for regular tetrahedral shape. Our theoretical results are compared with the available experimental or simulation data. Results predicted by our model are in good agreement with experimental observations.
表面原子和悬空键会影响材料的热力学性质。提出了一种基于内聚能的热力学模型来讨论材料在纳米尺度上的熔化特性。利用该模型研究了尺寸和形状对Ni、Sn、Al和Cu金属纳米颗粒熔化温度Tmn、熔化熵Smn和熔化焓Hmn的影响。研究了纳米线、薄膜、球形、正四面体、六面体和八面体纳米颗粒中Tmn、Smn和Hmn的变化。据报道,Tmn、Smn和Hmn随着纳米颗粒尺寸的减小而减小,粒径越小,尺寸和形状效应越大,当粒径小于10 nm时,预测随着粒径的减小,Tmn、Smn和Hmn明显减小。同时,在相同尺寸下,纳米颗粒的形状越偏离球形,纳米颗粒的Smn和Hmn越小,纳米线形状的变化越小,而正四面体形状的变化越大。我们的理论结果与现有的实验或模拟数据进行了比较。模型预测结果与实验观测结果吻合较好。
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引用次数: 0
First-principle study of mechanical, optical and thermophysical properties of NiTiSn NiTiSn的力学、光学和热物理性质的第一性原理研究
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1227
A. Gour, Suman Yadav, Rahul A. Rathore, Sadhna Singh
In present work we have studied half-Heusler compound NiTiSn in perspective of optical, mechanical and thermophysical properties at high temperature and high pressure using density functional theory. We have calculated various dielectric properties viz absorption coefficients, optical conductivity, optical reflectivity and electron energy loss. We have also found high refractive index n(0) ≈ 5 of NiTiSn indicating highly denser medium for low energy waves. The calculated absorption coefficient and optical conductivity are in agreement with the experimental ones for optical device. The optical investigation of the compound shows high reflectivity in the UV region of the photon energy. The elastic properties are investigated in most stable structure of NiTiSn in order to ensure its mechanical applications. Our estimated values of Poisson ratio (n = 0.2735) and pughratio (B/G = 1.87) confirm the metallic nature of NiTiSn. Various thermophysical properties viz. Debye temperature, isothermal coefficients, heat capacity, entropy and volume have been studied at high temperature and high pressures which will upgrade its thermoelectric properties study. The thermophysical properties ensures the Debye T3 law and Dulong Petit limit of NiTiSn at high temperatures and high pressures.
本文利用密度泛函理论对半heusler化合物NiTiSn在高温高压下的光学性质、力学性质和热物理性质进行了研究。我们计算了各种介电性质,即吸收系数,光学电导率,光学反射率和电子能量损失。我们还发现NiTiSn的高折射率n(0)≈5表明低能量波的介质密度较高。计算的吸收系数和光电导率与光学器件的实验值基本一致。对该化合物的光学研究表明,该化合物在光子能量的紫外区具有较高的反射率。研究了最稳定结构下NiTiSn的弹性性能,以保证其力学应用。泊松比(n = 0.2735)和pughratio (B/G = 1.87)的估定值证实了NiTiSn的金属性质。在高温高压下研究了各种热物理性质,如德拜温度、等温系数、热容、熵和体积,这将提高其热电性质的研究水平。热物理性质保证了NiTiSn在高温高压下的Debye T3定律和Dulong Petit极限。
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引用次数: 0
OBITUARY: Ian Mellanby 讣告:Ian Mellanby
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.0929
Martin O�Neill
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引用次数: 0
Modeling to determine the size dependence of Debye temperature in monometallic and bimetallic nanoalloys 建立模型以确定单金属和双金属纳米合金中德拜温度的尺寸依赖性
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1123
M. Goyal, Madan Singh
A simple unified model is used to study the variation in Debye temperature in monometallic and bimetallic nanoalloys. In the present study, a systematic investigation of variation in Debye temperature is done to analyze the impact of size, shape, composition and dimension in monometallic and bimetallic nanoalloys. It is found that Debye temperature in monometallic and bimetallic nanoalloys decreases with decrease in size of nanoalloy. Moreover, for nanoalloys of same size and composition, the Debye temperature varies with dimension too. Debye temperature of nanofilms is found more than that of nanowires and nanoparticles. Debye temperature is also found to vary with shape of the nanoalloy due to change in surface area to volume ratio with shape. The predicted model results are found in good agreement with the available experimental results which justifies the suitability of the present model.
采用简单的统一模型研究了单金属和双金属纳米合金的德拜温度变化。在本研究中,系统地研究了德拜温度的变化,分析了单金属和双金属纳米合金的尺寸、形状、成分和尺寸的影响。发现单金属和双金属纳米合金的德拜温度随纳米合金尺寸的减小而减小。此外,对于相同尺寸和成分的纳米合金,德拜温度也随尺寸的变化而变化。纳米膜的德拜温度高于纳米线和纳米颗粒。由于纳米合金的表面积体积比随形状的变化而变化,因此德拜温度也随纳米合金的形状而变化。模型的预测结果与已有的实验结果吻合较好,证明了模型的适用性。
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引用次数: 0
Method for prediction of liquid-vapor critical points in binary mixtures: geometrical-EOS model 二元混合物中液-气临界点的预测方法:几何- eos模型
IF 1.1 4区 工程技术 Q4 Engineering Pub Date : 2022-01-01 DOI: 10.32908/hthp.v51.1125
H. Grine, H. Madani
A new method for predicting the Liquid- Vapor critical point of binary mixture, is presented, which is based in geometrical distances. Actually, the method is based on the minimization of the distance between the experimental and calculated values of the critical temperatures and critical pressures. The SRK and PR equations of state along with classical mixing rules of van der Waals were used as thermodynamic models to calculate the critical point of a given mixture. The proposed method requires that the mixture parameters a, b, and the covolume ε = b/v of each equation of state be determined at each iteration by solving the resulting cubic equation. For nine binary mixtures containing: hydrocarbon derivatives, carbon dioxide and alcohols are studied. The AARE of the calculated values is about 0.86% for critical temperature and 2.07% for critical pressure. Good agreements are found between the calculated results and experimental data. The technique is a general purpose one and can be applied in connection with other thermodynamic models.
提出了一种基于几何距离预测二元混合物液汽临界点的新方法。实际上,该方法是基于临界温度和临界压力的实验值与计算值之间的距离最小。采用SRK和PR状态方程和经典的范德华混合规则作为热力学模型,计算了给定混合物的临界点。该方法要求在每次迭代时,通过求解得到的三次方程来确定每个状态方程的混合参数a、b和协体积ε = b/v。对含烃衍生物、二氧化碳和醇的九种二元混合物进行了研究。计算值的AARE在临界温度和临界压力下分别为0.86%和2.07%。计算结果与实验数据吻合较好。该方法具有通用性,可与其它热力学模型结合使用。
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引用次数: 0
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High Temperatures-high Pressures
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