Heat Conduction Mechanism Research Articles

A new method for temperature field characterization of microsystems based on transient thermal simulation

Microsystems face challenges such as high heat flux density and localized hot spots in the temperature field, significantly impacting their thermal reliability. Accurately and comprehensively characterizing the temperature field is a challenging problem in current research. We present a general high-order finite difference (GHOFD) algorithm for the high-accuracy numerical solution of the two-dimensional transient heat conduction equations (THCEs). The 10th-order GHOFD algorithm is accurate up to 10-7 °C. Secondly, we present a viable approach for characterizing microsystems' steady-state and transient heat conduction mechanisms. We introduce two new characterization parameters: the gradient modulus and the heat flux direction factor (HFDF). The gradient modulus can more clearly characterize the magnitude of the gradient vector and quantitatively analyze the spatial position of the temperature field change in the microsystem. The HFDF can dynamically display the heat conduction process in the temperature field. Finally, using temperature field simulation and microsystem characterization, we have validated the effectiveness of the proposed method and new parameters.

Investigation of internal thermal distribution in inverted perovskite solar cell and improvement of its heat dissipation performance

Abstract COMSOL Multiphysics software was used to construct a numerical opto-electro-thermal coupling model to investigate the mechanisms of internal heat generation, conduction, and dissipation in inverted (p-i-n architecture) perovskite solar cells (PSCs). The research results indicate that Joule heating and Shockley-Read-Hall (SRH) recombination are the primary sources of heat, leading to significant accumulation of heat at the interfaces between the perovskite and the electron transport layer (ETL), as well as between the ETL and the electrode. This concentration of heat not only affects the performance of the device but also poses challenges for overall thermal management. Therefore, we compared four different top electrode materials (Ag, Cu, Al, and reduced graphene oxide) to assess their performance in terms of heat dissipation efficiency. The results showed that reduced graphene oxide (RGO) performed exceptionally well in heat dissipation efficiency, primarily due to its high thermal conductivity, which enables it to effectively reduce heat accumulation at the interfaces, thereby improving performance of PSCs. This finding provides important material selection criteria for optimizing the thermal management of PSCs.

Radiative-conductive heat transfer dynamics in dissipative dispersive anisotropic media

Abstract We develop a self-consistent theoretical formalism to model the dynamics of heat transfer in dissipative, dispersive, anisotropic nanoscale media, such as metamaterials. We employ our envelope dyadic Green’s function method to solve Maxwell’s macroscopic equations for the propagation of fluctuating electromagnetic fields in these media. We assume that the photonic radiative heat transfer mechanism in these media is complemented by dynamic phononic mechanisms of heat storage and conduction, accounting for effects of local heat generation. By employing the Poynting theorem and the fluctuation-dissipation theorem, we derive novel closed-form expressions for the radiative heat flux and the coupling term of photonic and phononic subsystems, which contains the heating rate and the radiative heat power contributions. We apply our formalism to the paraxial heat transfer in uniaxial media and present relevant closed-form expressions. By considering a Gaussian transverse temperature profile, we also obtain and solve a system of integro-differential heat diffusion equations to model the paraxial heat transfer in uniaxial reciprocal media. By applying the developed analytical model to radiative-conductive heat tranfer in nanolayered media constructed by layers of silica and germanium, we compute the temperature profiles for the three first orders of expansion and the total temperature profile as well. The results of this research can be of interest in areas of science and technology related to thermophotovoltaics, energy harvesting, radiative cooling, and thermal management at micro- and nanoscale.

Homogeneous removal of heterogeneous CFRP composite via aluminum/polyimide laminate assisted femtosecond laser processing

Carbon fiber reinforced polymer (CFRP) composed of carbon fiber and polymer matrix has been used in extensive applications due to its light weight and superior strength. However, the distinct difference in physicochemical properties between two constituents poses a significant challenge for laser homogeneous processing of heterogeneous CFRP. Herein, an aluminum/polyimide laminate is introduced onto CFRP as an assisting layer during femtosecond laser processing, which prevents CFRP from direct energy deposition of low-energy edge of the Gaussian laser. Moreover, a synergetic mechanism of horizontal heat conduction of aluminum foil and vertical heat insulation of polyimide film is proposed and confirmed through temperature measurements and simulation calculations. The heat is dissipated through the aluminum foil and obstructed by the polyimide film, alleviating the detrimental heat transfer and accumulation on CFRP. Therefore, it significantly inhibits thermal damage and entrance size expansion. Compared with traditional femtosecond laser direct processing, the maximum reduction ratio of HAZ and taper are up to 98% and 83%, respectively. High-quality CFRP homogeneous processing with an ultra-low HAZ (0.7 μm), minimal taper (0.07°) and intact smooth sidewalls can be achieved. The method shows great potential to dramatically improve processing quality and broaden applications of heterogeneous composites.

Mechanism and structure of micro-nanofluid directional heat conduction in asphalt pavement in plateau permafrost regions

Solar radiation in plateau permafrost regions is strong. The asphalt pavement strongly absorbs and slowly dissipates heat, leading to significant heat accumulation on the pavement. This accumulation disturbs the underlying permafrost and eventually causes serious pavement damage. To improve the heat resistance and dissipation capabilities of asphalt pavement, a nanofluid directional heat conduction structure (N-DHCS) was suggested and analyzed in this paper. The designed structure can resist heat in the daytime due to the low thermal conductivity of liquid and dissipates heat at night through natural convection. The finite element method and laboratory irradiation experiment were employed to performed thermal analyses of N-DHCS. The results demonstrated that establishing the N-DHCS in asphalt pavements can enhance active heat dissipation capacity, which is beneficial for protecting the frozen soil in plateau permafrost regions.

Exploring the Impact of Visual Heat Conduction Paths on Thermal Conductivity of Polymer Composites and the Practical Applications.

The theory of heat conduction paths has been widely recognized and widely studied in the research about the thermal conductivity of thermal conductive polymer composites at present. Encapsulating polymer pellets with thermally conductive fillers and processing them into thermally conductive polymer composites is a simple and effective method for constructing heat conduction paths. It is meaningful to investigate the related heat conduction mechanism of this method. Otherwise, this approach can significantly preserve the performance of the polymer substrate, making it highly valuable for practical material applications. In this work, polyethylene-octene elastomer (POE) pellets were encapsulated with thermal conductive fillers by physical absorption. Subsequently, the composite films containing heat conduction paths were fabricated using the encapsulated POE pellets through a heating press. Alumina (Al2O3), boron nitride (BN), and alumina/boron nitride hybrid (Al2O3/BN) fillers were used to prepare Al2O3@POE, BN@POE, and BN/Al2O3@POE composite films to investigate the influence of filler shapes on heat conduction path construction. The influence of the constitute and density of heat conduction paths on the thermal conductivity of composite films was analyzed by infrared thermal imaging, finite element analysis, and thermal resistance theory in detail. Owing to the reserved good adhesion and flexibility of the POE substrate, the composite films could be directly used as thermal interface materials for chip cooling, which presented a good heat dissipation effect. Furthermore, a series of integrated composite materials were prepared by the combination of encapsulated pellets with various functional films (copper foil, aluminum foil, and graphite sheet) through a one-pot heating press, exhibiting a good electromagnetic shielding effect. The performance of the composites and the corresponding preparation method demonstrate the strong significance of this research for practical applications.

Experimental study of solid particles in thermal energy storage systems for shell and tube heat exchanger: Effect of particle size and flow direction

The solid particle thermal energy storage method offers cost-effective, simple, and high-temperature suitable solutions. It effectively resolves chemical compatibility and thermal stress issues in shell-and-tube heat exchangers. This work studies the quartz sands' particle sizes and flow direction's impact on heat exchanger performance. The results show that heat conduction and natural convection heat transfer mechanisms exist on the particle side. Flow direction minimally affects charge/discharge time and stored energy but significantly impacts delivered/recovered energy and exergy and energy and exergy efficiencies. Optimal performance is achieved when HTO enters from the top during charging and from the bottom during discharging, creating a transparent thermal gradient of “Top Temperature High, Bottom Temperature Low”. This distribution minimizes natural convection losses, resulting in a 15–17 % increase in energy efficiency and an 11–13 % increase in exergy efficiency compared to reverse flow. Smaller particles show slightly faster temperature rise due to lower energy storage density. Large and medium particles perform well, achieving energy efficiencies of 81.5 % and 81.0 % and exergy efficiencies of 62.1 % and 61.8 %, respectively. Small particles have an energy efficiency of 79.0 % and an exergy efficiency of 60.4 %, possibly due to higher porosity and increased heat losses.

Understanding Compartmentation Failure for High-Rise Timber Buildings

The traditional concept of compartmentation guaranteed by fire resistance is mainly concerned with the problem of destructive internal spread potential. External convective spread potential pertains to the loss of compartmentation associated with windows and facade systems. As such, it is assumed that internal fire spread occurs following mechanisms of excessive heat conduction and/or successive failure of the compartment boundaries, which can be, in most cases, conservatively characterised using traditional methods of performance assessment such as fire resistance. Nevertheless, external fire spread represents a potentially more effective route by which fire can spread through the convective advancement of flames and hot gases. This is particularly important in cases such as timber construction, where the presence of exposed timber can result in increased convective spread potential and where loss of compartmentation can result in disproportionate consequences. A simplified compartment fire model is proposed with the objective of quantifying the fuel contribution of exposed timber elements to the compartment fire and determining the impact of variable percentages of exposed timber on the convective spread potential. The overall results show that the convective fire spread potential increases with the increasing percentage of available timber.

Thermal bridging effect enhancing heat transport across graphene interfaces with pinhole defects

Interfacial thermal conductance (G) is of critical significance to the efficient thermal management of two-dimensional (2D) material devices. Despite the importance of defects engineering in tuning G, the mechanisms of heat transport across defective graphene interfaces remain unclear. In this study, we have identified and demonstrated the origins of the enhanced heat transport across pinhole defective graphene through our ultrafast pump-probe measurements and molecular dynamics (MD) simulations. In prior work, the enhanced G across defective graphene interfaces was commonly attributed to the improved overlap of phonon density of states (DOS) or interfacial coupling strength. We, however, observe a remarkable 2.5-fold increase in heat conduction and a distinctly different temperature dependence of G for defective graphene with the same superstrate and substrate material, compared to pristine graphene. In contrast, interfaces with different superstrate and substrate materials show only minor changes (<15%) in thermal conductance after introducing defects in the graphene layer. Through careful analysis of our MD simulations for various defective graphene interfaces, we conclude that, contradictory to common beliefs, it is the formation of direct contact thermal bridge, instead of the improvement in the phonon DOS overlap or interfacial coupling strength, that has a decisive effect and promotes heat transport across defective graphene interfaces. The differing impacts of the thermal bridge on G of defective graphene sandwiched by layers of the same and different materials are primarily attributed to the varying coupling strength between the substrate and superstrate. Our work provides important insights and physical understandings of the mechanisms of heat conduction across defective graphene interfaces.

Lattice dynamics and heat transport in zeolitic imidazolate framework glasses.

The glassy state of zeolitic imidazolate frameworks (ZIFs) has shown great potential for energy-related applications, including solid electrolytes. However, their thermal conductivity (κ), an essential parameter influencing thermal dissipation, remains largely unexplored. In this work, using a combination of experiments, atomistic simulations, and lattice dynamics calculations, we investigate κ and the underlying heat conduction mechanism in ZIF glasses with varying ratios of imidazolate (Im) to benzimidazolate (bIm) linkers. The substitution of bIm for Imtunes the node-linker couplings but exhibits only a minor impact on the average diffusivity of low-frequency lattice modes. On the other hand, the linker substitution induces significant volume expansion, which, in turn, suppresses the contributions from lattice vibrations to κ, leading to decreased total heat conduction. Furthermore, spatial localization of internal high-frequency linker vibrations is promoted upon substitution, reducing their mode diffusivities. This is ascribed to structural deformations of the bIm units in the glasses. Our work unveils the detailed influences of linker substitution on the dual heat conduction characteristics of ZIF glasses and guides the κ regulation of related hybrid materials in practical applications.

Study on Preparation Technology and Heat Conduction Mechanism of High-Purity &amp; Ultra-Fine Alumina Powder from Scrap Aluminum Cans

In view of the increasing scarcity of bauxite resources in China, the high energy consumption and high pollution of electrolytic aluminum, and the requirements for energy conservation and environmental protection, aluminum recycling and high-value utilization of its derivatives have evolved into a crucial development requirement for the aluminum industry in the future. As an important part of the development of recycled aluminum resources, the high-value application of scrap aluminum cans has always been a hot research topic in various recycled aluminum processing enterprises and scientific research units. The traditional regeneration system of waste cans includes a series of complex technological processes such as pretreatment, paint removal, smelting system and casting system, which is difficult to control in the middle of the process. Most of the recycled scrap aluminum cans are cast and downgraded for later use, except for a part of them used as alloy materials for new cans. In this paper, combined with the research on the preparation of metal aluminum alkoxide, combined with recrystallization heat conduction to further study the effective dissolution or adsorption how to remove impurity elements to obtain high-purity aluminum alcohol salt mechanism research, and thermal effect of alcohols with different carbon chains on the synthesis of high-purity aluminum alkoxide was further investigated. Moreover, the changes in morphology and pore size distribution of hydrolyzed alumina precursor materials under different hydrothermal temperature conditions were discussed by means of the alkoxide hydrolysis-sol-gel process. Eventually, the aluminum alkoxide was obtained by the reaction of waste cans with isopropanol and heavy crystal thermal conductivity, and the high-purity aluminum alkoxide was purified by vacuum distillation. Under the hydrothermal condition of 160°C, the high-purity alumina material with a purity of 99.99% and an original crystal size of 200nm was prepared.

Molecular dynamics simulations of the effect of porosity on heat transfer in Li2TiO3

Heat transfer is a key consideration in the development of tritium breeder blankets for future fusion reactors. For solid tritium breeder materials there is a fine balance to be struck between high levels of porosity to encourage tritium release and minimising it to maintain the thermal and mechanical properties. Therefore, in this work we employ molecular dynamics simulations to understand how the introduction of porosity influences the thermal conductivity of lithium metatitanate ceramic breeder material. Our simulations predict that increasing the porosity leads to a decrease in the thermal conductivity which is in good agreement with previous experimental observations. By contrast, we do not observe the increase in the thermal conductivity at high temperatures, that is observed in some experiments. We argue that this increase is a consequence of sintering or some other modification of the experimental sample rather than a fundamental change in the heat conduction mechanism in the crystal matrix.

Extreme Thermal Insulation and Tradeoff of Thermal Transport Mechanisms between Graphene and WS2 Monolayers.

Controlling and understanding the heat flow at a nanometer scale are challenging, but important for fundamental science and applications. Two-dimensional (2D) layered materials provide perhaps the ultimate solution for meeting these challenges. While there have been reports of low thermal conductivities (several mW m-1 K-1) across the 2D heterostructures, phonon-dominant thermal transport remains strong due to the nearly-ideal contact between the layers. Here, this work experimentally explores the heat transport mechanisms by increasing the interlayer distance from perfect contact to a few nanometers and demonstrates that the phonon-dominated thermal conductivity across the WS2/graphene interface decreases further with the increasing interlayer distance until the air-dominated thermal conductivity increases again. This work finds that the resulting tradeoff of the two heat conduction mechanisms leads to the existence of a minimum thermal conductivity at 2.11nm of 1.41×10-5W m-1 K-1, which is two thousandths of the smallest value reported previously. This work provides an effective methodology for engineering thermal insulation structures and understanding heat transport at the ultimate small scales.

Impact of nanoparticle agglomeration on thermal conductivity of molten salt based nanofluids: Insights from molecular dynamics and lattice Boltzmann methods

The nanoparticle aggregation has significant influence on heat transfer properties. The contradictions between different researches exist and the underlying mechanisms of heat conduction remain unclear. To address these issues, the thermal conductivity of solar salt-SiO2 nanofluids in the non-aggregated and aggregated states was investigated, based on the combination of the advantages of molecular dynamics (MD) in revealing physical insights and lattice Boltzmann method (LBM) in simulating properties for complex structures. LBM models were simplified on the basic of MD results. Different heat transfer physics in nanofluids at nanoscale and mesoscale were compared. The results show that the thermal conductivity of aggregated nanofluid is higher than the non-aggregated nanofluid. By analyzing the diffusion coefficient, number density and vibrational density of states, we found that the previous hypotheses (such as Brownian motion, interfacial layer and interfacial thermal resistance) cannot explain the enhanced thermal conductivity induced by the nanoparticle agglomeration. The heat transfer mechanisms of aggregated nanofluid were further analyzed from new perspectives, i.e., the contributions of different material components and fluctuation modes to heat flux. It is found that the nanoparticle aggregation leads to the nanoparticle contribution increase, indicating the formation of low thermal resistance channels within the aggregates. The heat conduction contributed by collision decreases in the aggregated state, while that contributed by potential energy increases. Moreover, the thermal conductivity of aggregated nanofluid is negatively correlated with temperature, aggregate size and fractal dimension of agglomerates, and positively correlated with mass fraction of nanoparticles, degree of agglomeration, and backbone length of each aggregate.

Enhanced Heat Dissipation for Macroscopic Metals Achieved by a Single‐Layer Graphene

AbstractThe increasing demand for high‐performance devices on heat dissipation makes it approach the bottleneck even for metals with high thermal conductivities. The coating of only one layer of graphene, the heat dissipation performances of Cu, Ag, and Al can be further enhanced, e.g., with a maximum temperature reduction by ≈9% for a Cu foil is demonstrated. Molecular dynamics (MD) analysis of spectral phonon transmission reveals that low‐frequency phonons play a significant role in the thermal transport within the Cu/single‐layer graphene (SLG) system, and the high‐frequency phonons exhibit substantial mismatch. It suggests that the thermal anisotropy of graphene enables a rapid heat dispersion in the in‐plane direction and provides an effective thermal insulation in the out‐of‐plane direction. The thermal conductivity calculations demonstrate an enhanced participation of phonons in heat conduction by the graphene layer, indicating a novel heat conduction mechanism in the Cu/single‐layer graphene system. These findings highlight the positive impact of graphene on the heat conduction of metals, and they will hold crucial implications for the design and application of graphene‐based thermal devices is believed.

Interlayer growth of SiC nanowires in graphene aerogel for thermal conductivity enhancement of epoxy resin and its mechanism

AbstractThe chemical reduction method is a simple and popular way to contrast the graphene network to improve the polymer matrix's thermal conductivity. And hybrid thermal conductive fillers composed of two or more mixed fillers through chemical synthesis usually have better thermal conductivity because of the synergistic effort. In this work, silicon carbide nanowires (SiC NWs) in graphene aerogels are synthesized with the chemical vapor deposition method, acting as bridges for phonon transmission between adjacent graphene sheets. The RGO/SiC NWs aerogel‐endowed EP composites have a high thermal conductivity of 3.79 W/mK at a filler loading of 5.5 wt%, and 4.23 W/mK at a filler loading of 7.5 wt%, which is 1895% and 2126% higher than pure EP resin, respectively. Finite element analysis (FEA) is utilized to analyze the heat conduction mechanism of composites at last.

Thermal Conductivity of MoS2 and Graphene/MoS2 Heterojunction

With the development of the miniaturization of electronic devices, controlling heat dissipation has become a key factor, which affects the service life of devices and energy utilization efficiency. Therefore, it is particularly important to study the heat conduction mechanism of nanomaterials inside microelectronic devices. Herein, the thermal conductivity of MoS2 and graphene/MoS2 heterojunctions using the bond‐order–length–strength theory and the local bond average method is quantitatively analyzed; the functional relationship between the thermal conductivity and the number of layers, temperature, and pressure is established; and the variation trend of thermal conductivity of materials with these factors is studied. The results show that the thermal conductivity of MoS2 and graphene/MoS2 heterojunctions is inversely proportional to the number of layers and temperature, proportional to the pressure. The work provides a simple and effective method for the study of thermal transport properties of 2D materials and heterojunction systems from the perspective of chemical bonding changes at the atomic level.

Modeling of Short-Pulse Laser Interactions with Monolithic and Porous Silicon Targets with an Atomistic-Continuum Approach.

The acquisition of reliable knowledge about the mechanism of short laser pulse interactions with semiconductor materials is an important step for high-tech technologies towards the development of new electronic devices, the functionalization of material surfaces with predesigned optical properties, and the manufacturing of nanorobots (such as nanoparticles) for bio-medical applications. The laser-induced nanostructuring of semiconductors, however, is a complex phenomenon with several interplaying processes occurring on a wide spatial and temporal scale. In this work, we apply the atomistic-continuum approach for modeling the interaction of an fs-laser pulse with a semiconductor target, using monolithic crystalline silicon (c-Si) and porous silicon (Si). This model addresses the kinetics of non-equilibrium laser-induced phase transitions with atomic resolution via molecular dynamics, whereas the effect of the laser-generated free carriers (electron-hole pairs) is accounted for via the dynamics of their density and temperature. The combined model was applied to study the microscopic mechanism of phase transitions during the laser-induced melting and ablation of monolithic crystalline (c-Si) and porous Si targets in a vacuum. The melting thresholds for the monolithic and porous targets were found to be 0.32 J/cm2 and 0.29 J/cm2, respectively. The limited heat conduction mechanism and the absence of internal stress accumulation were found to be involved in the processes responsible for the lowering of the melting threshold in the porous target. The results of this modeling were validated by comparing the melting thresholds obtained in the simulations to the experimental values. A difference in the mechanisms of ablation of the c-Si and porous Si targets was considered. Based on the simulation results, a prediction regarding the mechanism of the laser-assisted production of Si nanoparticles with the desired properties is drawn.

High thermal conductivity of porous graphite/paraffin composite phase change material with 3D porous graphite foam

Phase change materials (PCMs) are widely used in the field of thermal management and energy storage, but both low thermal conductivity and leakage problem limit their broad applications. In this work, a 3D porous graphite (PG) foam was prepared by a pressing and drying method with solid mixture of graphite powder and ammonium bicarbonate (NH4HCO3), and it was used as the thermal conductive skeleton and shape stabilizer of PCMs. PG/paraffin composite PCMs (CPCMs) were then prepared by the vacuum impregnation of liquid paraffin into PG foam. It showed that the skeleton of 3D PG foam greatly improves the thermal conductivity of CPCMs. The prepared PG/paraffin CPCMs exhibited an ultra-high thermal conductivity of 19.27 Wm-1K−1 at a volume fraction 35.55% of graphite, which is about 76.08 times higher than that of paraffin. The heat conduction mechanism of the PG/paraffin CPCMs are analyzed, and it is found that Maxwell-Eucken model can be used to accurately predict its thermal conductivity. Moreover, the CPCMs show good performance of thermal shape stability and exhibit superior anti-leakage characteristic. The proposed method for the preparation of 3D PG foam is robust, and the excellent performance of their based CPCMs will be promising in the field of heat dissipation and thermal storage.

A Hybrid Model for Billet Tapping Temperature Prediction and Optimization in Reheating Furnace

To predict and optimize the billet heating process in reheating furnace for rolling mills, this paper proposes a hybrid model that combines data-driven model with traditional mechanism knowledge, abbreviated as HMDM. By examining the heat conduction mechanism, a billet temperature distribution equation is established. Then, the billet temperature distribution in each heating zone is calculated and spliced with the corresponding process parameters. The Stacked-AutoEncoder is utilized to extract the features of process parameters, and the Long Short Term Memory model is employed to predict the temperature. Finally, using the previous predictions, the parameters of the subsequent heating stage are optimized and adjusted during the heating process. The experimental results on the real steel plant verify the effectiveness of HMDM. For example, the temperature prediction error has been reduced to less than <inline-formula xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink"><tex-math notation="LaTeX">$4^{\circ }$</tex-math></inline-formula> C, and the number of billets with abnormal tapping temperature has been decreased by <inline-formula xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink"><tex-math notation="LaTeX">$42.9\%$</tex-math></inline-formula> .