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在泵浦和脉冲诱导状态下观察到的带电畴壁网络和小球的建模。

Modeling of networks and globules of charged domain walls observed in pump and pulse induced states.

作者信息

Karpov Petr, Brazovskii Serguei

机构信息

National University of Science and Technology "MISiS", Moscow, Russia.

CNRS UMR 8626 LPTMS, University of Paris-Sud, University of Paris-Saclay, Orsay, France.

出版信息

Sci Rep. 2018 Mar 6;8(1):4043. doi: 10.1038/s41598-018-22308-7.

Abstract

Experiments on optical and STM injection of carriers in layered MX materials revealed the formation of nanoscale patterns with networks and globules of domain walls. This is thought to be responsible for the metallization transition of the Mott insulator and for stabilization of a "hidden" state. In response, here we present studies of the classical charged lattice gas model emulating the superlattice of polarons ubiquitous to the material of choice 1T - TaS. The injection pulse was simulated by introducing a small random concentration of voids which subsequent evolution was followed by means of Monte Carlo cooling. Below the detected phase transition, the voids gradually coalesce into domain walls forming locally connected globules and then the global network leading to a mosaic fragmentation into domains with different degenerate ground states. The obtained patterns closely resemble the experimental STM visualizations. The surprising aggregation of charged voids is understood by fractionalization of their charges across the walls' lines.

摘要

对层状MX材料中载流子的光学和扫描隧道显微镜注入实验揭示了纳米级图案的形成,这些图案具有畴壁网络和小球。这被认为是莫特绝缘体金属化转变以及“隐藏”态稳定的原因。作为回应,我们在此展示了对经典带电晶格气体模型的研究,该模型模拟了所选材料1T-TaS中普遍存在的极化子超晶格。通过引入少量随机浓度的空位来模拟注入脉冲,随后通过蒙特卡罗冷却跟踪其演化。在检测到的相变温度以下,空位逐渐聚结成畴壁,形成局部相连的小球,然后形成全局网络,导致镶嵌成具有不同简并基态的畴。所获得的图案与实验扫描隧道显微镜图像非常相似。带电空位的惊人聚集可通过其电荷在畴壁线上的分数化来理解。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/92a1/5840135/3958dde0a212/41598_2018_22308_Fig1_HTML.jpg

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