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应变能势对VO薄膜相变特性的界面效应

Interface Effects of Strain-Energy Potentials on Phase Transition Characteristics of VO Thin-Films.

作者信息

Lappalainen Jyrki, Kangaspuoskari Matti

机构信息

Civil Engineering Research Unit, Faculty of Technology, University of Oulu, P.O. Box 8000, FIN-90014 Oulu, Finland.

出版信息

ACS Omega. 2023 May 30;8(23):21083-21095. doi: 10.1021/acsomega.3c01966. eCollection 2023 Jun 13.

Abstract

Metal-insulator-transition (MIT) of VO has attracted strong attention as a potential phenomenon to be utilized in nanostructured devices. Dynamics of MIT phase transition determines the feasibility of VO material properties in various applications, for example, photonic components, sensors, MEMS actuators, and neuromorphic computing. However, conventional interface strain model predicts the MIT effect accurately for bulk, but fairly for the thin films, and thus, a new model is needed. It was found that the VO thin film-substrate interface plays a crucial role in determining transition dynamics properties. In VO thin films on different substrates, coexistence of insulator-state polymorph phases, dislocations, and a few unit cell reconstruction layer form an interface structure minimizing strain energy by the increase of structural complexity. As a consequence, MIT temperature and hysteresis of structure increased as the transition enthalpy of the interface increased. Thus, the process does not obey the conventional Clausius-Clapeyron law anymore. A new model is proposed for residual strain energy potentials by implementing a modified Cauchy strain. Experimental results confirm that the MIT effect in constrained VO thin films is induced through the Peierls mechanism. The developed model provides tools for strain engineering in the atomic scale for crystal potential distortion effects in nanotechnology, such as topological quantum devices.

摘要

VO的金属-绝缘体转变(MIT)作为一种有望在纳米结构器件中应用的潜在现象,已引起了广泛关注。MIT相变动力学决定了VO材料特性在各种应用中的可行性,例如光子组件、传感器、微机电系统(MEMS)致动器和神经形态计算。然而,传统的界面应变模型对块状材料能准确预测MIT效应,但对薄膜的预测效果一般,因此需要一种新模型。研究发现,VO薄膜-衬底界面在决定转变动力学特性方面起着关键作用。在不同衬底上的VO薄膜中,绝缘体态多晶型相、位错和几个晶胞重构层共存,通过增加结构复杂性形成了一种使应变能最小化的界面结构。结果,随着界面转变焓的增加,MIT温度和结构滞后现象也增加。因此,该过程不再遵循传统的克劳修斯-克拉佩龙定律。通过实施修正的柯西应变,提出了一种残余应变能势的新模型。实验结果证实,受限VO薄膜中的MIT效应是通过派尔斯机制诱导产生的。所开发的模型为纳米技术中晶体势畸变效应(如拓扑量子器件)的原子尺度应变工程提供了工具。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6070/10268292/febf5fcbcd6d/ao3c01966_0002.jpg

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