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Understanding the thermal properties of two-dimensional (2D) materials and devices is essential for thermal management of 2D applications. Here we perform molecular dynamics simulations to evaluate both the specific heat of $MoS_{2}$ as…

Mesoscale and Nanoscale Physics · Physics 2019-08-02 Saurabh V. Suryavanshi , Alexander J. Gabourie , Amir Barati Farimani , Eric Pop

For the development of nanoscale electronics and photonics using atomically thin two-dimensional (2D) materials, it is important to realize van der Waals (vdW) interfaces with low thermal resistance, to minimize performance reduction caused…

Two-dimensional transition metal dichalcogenides (TMDs) exhibit remarkable thermal anisotropy due to their strong intralayer covalent bonding and weak interlayer van der Waals (vdW) interactions. However, accurately modeling their thermal…

Computational Physics · Physics 2025-05-02 Wenwu Jiang , Hekai Bu , Ting Liang , Penghua Ying , Zheyong Fan , Jianbin Xu , Wengen Ouyang

Probing the ideal limit of interfacial thermal conductance (ITC) in two-dimensional (2D) heterointerfaces is of paramount importance for assessing heat dissipation in 2D-based nanoelectronics. Using graphene/hexagonal boron nitride…

Artificially engineered 2D materials offer unique physical properties for thermal management, surpassing naturally occurring materials. Here, using van der Waals epitaxy, we demonstrate the ability to engineer extremely insulating…

Increased power density in modern microelectronics has led to thermal management challenges which can cause degradation in performance and reliability. In many high-power electronic devices, the power consumption and heat removal are…

Mesoscale and Nanoscale Physics · Physics 2019-10-01 David B. Brown , Thomas L. Bougher , Xiang Zhang , Pulickel Ajayan , Baratunde A. Cola , Satish Kumar

Two-dimensional (2D) van der Waals (vdW) materials have extraordinary thermal properties due to the effect of quantum confinement, making them promising for thermoelectric energy conversion and thermal management in microelectronic devices.…

Materials Science · Physics 2022-10-18 Xuefei Yan , Bowen Wang , Yulong Hai , Devesh R. Kripalani , Qingqing Ke , Yongqing Cai

An advanced modeling approach is presented to shed light on the thermal transport properties of van der Waals materials (vdWMs) composed of single-layer transition metal dichalcogenides (TMDs) stacked on top of each other with a total or…

Materials Science · Physics 2020-10-08 Sara Fiore , Mathieu Luisier

GaN/AlN interfaces are essential in advanced high-power and high-frequency electronic devices, where effective thermal management is crucial for optimal performance and reliability. This work investigates the thermal boundary conductance…

Mesoscale and Nanoscale Physics · Physics 2025-05-16 Hao Zhou , Khalid Zobaid Adnan , Wyatt Allen Jones , Tianli Feng

In nano-device applications using 2D van der Waals materials, a heat dissipation through nano-scale interfaces can be a critical issue for optimizing device performances. By using a time-domain thermoreflectance measurement technique, we…

Mesoscale and Nanoscale Physics · Physics 2018-12-07 Young-Gwan Choi , Do-Gyeom Jeong , H. I. Ju , C. J. Roh , Geonhwa Kim , Bongjin Simon Mun , Tae Yun Kim , Sang-Woo Kim , J. S. Lee

Van der Waals layered chalcogenide-based flexible thermoelectric devices show great potential for applications in wearable electronics. However, materials that are both highly deformable and exhibit superior thermoelectric performance are…

Materials Science · Physics 2024-10-10 Qi Ren , Yingzhuo Lun , Bonan Zhu , Gang Tang , Jiawang Hong

Efficient and precise calculations of thermal transport properties and figure of merit, alongside a deep comprehension of thermal transport mechanisms, are essential for the practical utilization of advanced thermoelectric materials. In…

Understanding the physical processes involved in interfacial heat transfer is critical for the interpretation of thermometric measurements and the optimization of heat dissipation in nanoelectronic devices that are based on transition metal…

Mesoscale and Nanoscale Physics · Physics 2021-01-12 Zhun-Yong Ong , Yongqing Cai , Gang Zhang , Yong-Wei Zhang

Two-dimensional (2D) topological superconductors are highly desired because they not only offer opportunities for exploring novel exotic quantum physics, but also possesses potential applications in quantum computation. However, there are…

Superconductivity · Physics 2021-03-10 Jing-Yang You , Bo Gu , Gang Su , Yuan Ping Feng

The lattice thermal expansion and conductivity in bulk Mo and W-based transition metal dichalcogenides are investigated by means of density functional and Boltzmann transport theory calculations. To this end, a recent van der Waals density…

Materials Science · Physics 2021-01-14 Daniel O. Lindroth , Paul Erhart

Cross-plane heat transport is a critical bottleneck for van der Waals (vdW) electronics, yet its microscopic governing principles remain elusive. We demonstrate that stacking order is an effective control knob for cross-plane phonon…

Materials Science · Physics 2026-02-17 Yongjian Zhou , Haoran Cui , Zefang Ye , Jung-Fu Lin , Yan Wang , Yaguo Wang

Efficient heat dissipation to the substrate is crucial for optimal device performance in nanoelectronics. We develop a theory of electronic thermal boundary conductance (TBC) mediated by remote phonon scattering for the single-layer…

Mesoscale and Nanoscale Physics · Physics 2020-09-28 Zhun-Yong Ong , Gang Zhang , Linyou Cao , Yong-Wei Zhang

With the miniaturization and integration of nanoelectronic devices, efficient heat removal becomes a key factor affecting the reliable operation of the nanoelectronic device. With the high intrinsic thermal conductivity, good mechanical…

Materials Science · Physics 2022-02-16 Chen Shen , Lei Wang , Donghai Wei , Yixuan Zhang , Guangzhao Qin , Xing-Qiu Chen , Hongbin Zhang

The electrical and thermal behavior of nanoscale devices based on two-dimensional (2D) materials is often limited by their contacts and interfaces. Here we report the temperature-dependent thermal boundary conductance (TBC) of monolayer…

Quantitative descriptions of the structure-thermal property correlation have been a bottleneck in designing materials with superb thermal properties. In the past decade, the first-principles phonon calculations using density functional…

Materials Science · Physics 2021-10-19 Xin Qian , Ronggui Yang
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