LEAPS-MPS: Tailoring the Thermal Properties of Flexible Two-Dimensional (2D) Heterostructures

LEAPS-MPS：定制柔性二维 (2D) 异质结构的热性能

• 批准号: 2137883
• 负责人: Xian Zhang
• 金额: $ 25万
• 依托单位: Stevens Institute of Technology
• 依托单位国家: 美国
• 项目类别: Continuing Grant
• 财政年份: 2022
• 资助国家: 美国
• 起止时间: 2022-06-01 至 2024-05-31
• 项目状态: 已结题
• 来源: https://www.nsf.gov/awardsearch/showAward?AWD_ID=2137883&HistoricalAwards=false
• 关键词: LEAPS; MPS; Tailoring; Thermal; Properties

This award is funded in whole or in part under the American Rescue Plan Act of 2021 (Public Law 117-2). NONTECHNICAL DESCRIPTION. Recent advances in atomically thin crystals derived from layered materials have enabled the creation of two-dimensional (2D) heterostructures with unique properties. These heterostructures have a variety of applications, including wearable devices, microelectronics cooling, and generation of electricity from waste heat (thermoelectricity). One challenge for flexible electronics based on 2D materials is managing heat under mechanical stress while maintaining performance. Further innovations require an efficient thermal control strategy to address this issue. The objective of this project is to examine the fundamental aspects of thermal transport in 2D heterostructures and achieve efficient thermal control via structural tailoring. This research advances the current frontiers of two-dimensional materials and devices. This study is expected to elucidate the essential thermal physics and open a new route for the exploration of future electronics by leveraging unique thermal properties of 2D materials and structures. This work addresses the grand challenge of global sustainable energy solutions by enabling innovative design solutions of electronic devices. The project will use thermal technology as a motivator to engage students via interactive games about the wave nature of thermal transport, workshops and curriculum crosslinking art and engineering, and mentorships for women students. The PI will work with a broad range of students, from K-12 to graduate students, with students with developmental delays and those underrepresented in STEM. This project will generate extraordinary materials and inspire students through educational activities. TECHNICAL DESCRIPTION. The research objective of this project is to investigate and control the fundamental thermal behavior in two-dimensional heterostructures via structural tailoring. Understanding structural effects on thermal properties will be harnessed to derive a learning-based framework and directly validated by experiments. Experimental approaches of materials synthesis, device nanofabrication and thermal characterization are emphasized and reinforced by analytical modeling and computer simulations. Specifically, a dual laser at same side opto-thermal Raman technique will be used to perform direction-dependent and anisotropic thermal characterizations on structurally tailored two-dimensional heterostructures. The proposed research activities, aiming at investigating new thermal physics and developing novel device technological precursors, provide a firsthand, in-depth understanding of how to control thermal behavior of two-dimensional materials via structural tailoring and provide a pathway to the development of innovative two-dimensional heterostructure devices with ultra-efficient performance. The outcome of this project is expected to be a major leap in fundamental understanding of structure-thermal couplings, enabling unprecedented thermal control methods, and revolutionize future electronic platforms.This award reflects NSF's statutory mission and has been deemed worthy of support through evaluation using the Foundation's intellectual merit and broader impacts review criteria.

该奖项的全部或部分资金根据《2021 年美国救援计划法案》（公法 117-2）提供。非技术描述。源自层状材料的原子薄晶体的最新进展使得能够创建具有独特性质的二维（2D）异质结构。这些异质结构具有多种应用，包括可穿戴设备、微电子冷却和废热发电（热电）。基于 2D 材料的柔性电子产品面临的一项挑战是在保持性能的同时管理机械应力下的热量。进一步的创新需要有效的热控制策略来解决这个问题。该项目的目标是研究二维异质结构中热传输的基本方面，并通过结构定制实现有效的热控制。这项研究推进了二维材料和器件的当前前沿。这项研究有望阐明基本的热物理原理，并利用二维材料和结构的独特热特性为探索未来电子学开辟新途径。这项工作通过实现电子设备的创新设计解决方案来应对全球可持续能源解决方案的巨大挑战。该项目将利用热技术作为动力，通过有关热传输波动性质的互动游戏、艺术与工程交叉的研讨会和课程以及对女学生的指导来吸引学生。 PI 将与广泛的学生合作，从 K-12 学生到研究生，其中包括发育迟缓的学生和 STEM 领域代表性不足的学生。该项目将产生非凡的材料并通过教育活动激励学生。技术说明。该项目的研究目标是通过结构剪裁研究和控制二维异质结构的基本热行为。了解结构对热性能的影响将被用来导出基于学习的框架并通过实验直接验证。通过分析建模和计算机模拟强调和加强材料合成、器件纳米制造和热表征的实验方法。具体来说，同侧双激光器光热拉曼技术将用于对结构定制的二维异质结构进行方向相关和各向异性热表征。拟议的研究活动旨在研究新的热物理和开发新颖的器件技术先驱，提供对如何通过结构定制控制二维材料的热行为的第一手、深入的了解，并为创新二维材料的发展提供途径。具有超高效性能的三维异质结构器件。该项目的成果预计将在对结构-热耦合的基本理解上实现重大飞跃，实现前所未有的热控制方法，并彻底改变未来的电子平台。该奖项反映了 NSF 的法定使命，并通过使用基金会的智力价值和更广泛的影响审查标准。

项目成果

On the role of crystal defects on the lattice thermal conductivity of monolayer WSe2 (P63/mmc) thermoelectric materials by DFT calculation

利用DFT计算研究晶体缺陷对单层WSe2(P63/mmc)热电材料晶格热导率的影响

• DOI: 10.1016/j.spmi.2021.107057
• 发表时间: 2021-07-21
• 期刊: Superlattices and Microstructures
• 影响因子: 3.1
• 作者: Yingtao Wang;Xian Zhang
• 通讯作者: Xian Zhang

On The Role of Crystal Defects on The Lattice Thermal Conductivity of Monolayer WSe2 (P63/mmc) Thermoelectric Materials by DFT Calculation

用DFT计算研究晶体缺陷对单层WSe2(P63/mmc)热电材料晶格热导率的影响

• 发表时间: 2021-12
• 期刊: Superlattices and microstructures
• 影响因子: 3.1
• 作者: Yingtao Wang; Xian Zhang
• 通讯作者: Xian Zhang