Lee Juho, Khan Muhammad Ejaz, Kim Yong-Hoon
School of Electrical Engineering, Korea Advanced Institute of Science and Technology (KAIST), Daejeon, 34141, Korea.
Department of Computer Engineering, National University of Technology, Islamabad, 44000, Pakistan.
Nano Converg. 2022 Jun 1;9(1):25. doi: 10.1186/s40580-022-00314-w.
While low-dimensional organometal halide perovskites are expected to open up new opportunities for a diverse range of device applications, like in their bulk counterparts, the toxicity of Pb-based halide perovskite materials is a significant concern that hinders their practical use. We recently predicted that lead triiodide (PbI) columns derived from trimethylsulfonium (TMS) lead triiodide (CH)SPbI (TMSPbI) by stripping off TMS ligands should be semimetallic, and additionally ultrahigh negative differential resistance (NDR) can arise from the heterojunction composed of a TMSPbI channel sandwiched by PbI electrodes. Herein, we computationally explore whether similar material and device characteristics can be obtained from other one-dimensional halide perovskites based on non-Pb metal elements, and in doing so deepen the understanding of their mechanistic origins. First, scanning through several candidate metal halide inorganic frameworks as well as their parental form halide perovskites, we find that the germanium triiodide (GeI) column also assumes a semimetallic character by avoiding the Peierls distortion. Next, adopting the bundled nanowire GeI-TMSGeI-GeI junction configuration, we obtain a drastically high peak current density and ultrahigh NDR at room temperature. Furthermore, the robustness and controllability of NDR signals from GeI-TMSGeI-GeI devices under strain are revealed, establishing its potential for flexible electronics applications. It will be emphasized that, despite the performance metrics notably enhanced over those from the TMSPbI case, these device characteristics still arise from the identical quantum hybridization NDR mechanism.
虽然低维有机金属卤化物钙钛矿有望为各种器件应用带来新机遇,与体相材料类似,基于铅的卤化物钙钛矿材料的毒性是阻碍其实际应用的一个重大问题。我们最近预测,通过剥离三甲基锍(TMS)配体从三甲基锍铅三碘化物((CH₃)₃SPbI₃,TMSPbI₃)衍生出的碘化铅(PbI)柱应该是半金属性的,此外,由PbI电极夹着的TMSPbI₃通道组成的异质结会产生超高的负微分电阻(NDR)。在此,我们通过计算探索基于非铅金属元素的其他一维卤化物钙钛矿是否能获得类似的材料和器件特性,并借此加深对其机理起源的理解。首先,在扫描了几种候选金属卤化物无机框架及其母体形式的卤化物钙钛矿后,我们发现碘化锗(GeI₃)柱通过避免佩尔斯畸变也呈现半金属特性。接下来,采用捆绑纳米线GeI₃ - TMSGeI₃ - GeI₃结结构,我们在室温下获得了极高的峰值电流密度和超高的NDR。此外,揭示了GeI₃ - TMSGeI₃ - GeI₃器件在应变下NDR信号的稳健性和可控性,确立了其在柔性电子应用中的潜力。需要强调的是,尽管性能指标比TMSPbI₃的情况有显著提高,但这些器件特性仍然源于相同的量子杂化NDR机制。