Explanipedia

Realization of Tunable Atomic-Scale Magnetic Coupling by Hydrogen Chemisorbed on Graphene Open

Chong Li, Pengfei Yuan, Fei Wang, Chunyao Niu, Yu Jia · 2025

Photooxidation triggered ultralong afterglow in carbon nanodots Open

Guangsong Zheng, Cheng‐Long Shen, Chunyao Niu, Qing Lou, Tianci Jiang , et al. · 2024

Room‐Temperature Macroscopic Ferromagnetism in Multilayered Graphene Oxide Open

Di Zhang, Bo Gao, Song Xu, Chunyao Niu, Qun Xu · 2024

Graphene has a long spin lifetime and hyperfine interactions, favoring its potential application as spintronics. Despite the recent discoveries of spin‐containing graphene materials, graphene‐based materials with room‐temperature macroscop…

First-Principles Prediction of Novel Two-Dimensional Selenium Allotropes Open

Chunxiang Zhao, Jiaqi Wang, Aihua Wang, Chong Li, Chunyao Niu , et al. · 2024

Electronic, Magnetic and Catalytic of the Janus Monolayer Transition-Metal Trichalcogenides Open

Peng Yang, Jing Xu, Panpan Wang, Yuxin Liu, Fanguang Zeng , et al. · 2024

Searching for the Sizable Atomic-Scale Magnetism: A Comparative Study of Boron/Hydrogen Chemisorbed on Topological Defects in Graphene Open

Shuai Zhang, Bin Cui, Chunyao Niu, Fei Wang, Chong Li , et al. · 2024

Transformation of Organosolv Lignin into Sustainable Aromatics: Catalytic Hydrodeoxygenation Using Carbon-Supported Bimetallic Moru Catalyst Open

Matthew Tymchyshyn, Chunyao Niu, Armin Rezayan, Yongsheng Zhang, Chunbao Xu · 2024

Carbon Nanodots with Nearly Unity Fluorescent Efficiency Realized via Localized Excitons Open

Qing Lou, Qingchao Ni, Chunyao Niu, Jianyong Wei, Zhuangfei Zhang , et al. · 2023

Adv. Sci. 2022, 9, 2203622 DOI: 10.1002/advs.202203622 In the original published article there is a wrong point between 2015 and 2016 in the statistical diagram of Figure 5b. Please find below the correct Figure 5.

Carbon Nanodots with Nearly Unity Fluorescent Efficiency Realized via Localized Excitons Open

Qing Lou, Qingchao Ni, Chunyao Niu, Jianyong Wei, Zhuangfei Zhang , et al. · 2022

Carbon nanodots (CDs) have emerged as an alternative option for traditional nanocrystals due to their excellent optical properties and low toxicity. Nevertheless, high emission efficiency is a long‐lasting pursuit for CDs. Herein, CDs with…

Computational and Experimental Studies on Band Alignment of Gan/Inxga2-Xo3 /Znoheterojunctions Open

Xilai Liu, Chunxiang Zhao, Yihan Li, Chunyao Niu, Yu Jia · 2022

Surface Van Hove Singularity Enabled Efficient Catalysis: The Cases of CO Oxidation and Hydrogen Evolution Reactions Open

Liangliang Liu, Chunyan Wang, Liying Zhang, Chengyan Liu, Chunyao Niu , et al. · 2021

Surface Van Hove singularity (SVHS), defined as the surface states near the Fermi level (EF) in low-dimensional systems, triggers exciting physical phenomena distinct from bulk. We herein explore theoretically the potential role of SVHS in…

Erratum: “A promising auxetic material of CaAs3 monolayer with anisotropic electro-mechanical and optical properties” [Appl. Phys. Lett. <b>119</b>, 063103 (2021)] Open

Xiaoyu Huang, Chunyao Niu, Jinping Zhang, Aihua Wang, Yu-Ling Song , et al. · 2021

First Page

Uniaxial strain induced symmetry lowering and valleys drift in MoS<sub>2</sub> Open

Cunyuan Jiang, Wen Xiong, Chong Li, Chunyao Niu, Fei Wang · 2021

The uniaxial strain is an effective way to change the symmetry of a crystal and thus tuning their electronic properties. In the present work, we elucidate the physical mechanism of the symmetry-broken-induced energy valleys drift in monola…

Carbon Nanodots With Nearly Unity Fluorescent Efficiency Realized via Localized Excitons Open

Qing Lou, Chunyao Niu, Jianyong Wei, Zhuangfei Zhang, Weixia Shen , et al. · 2021

Strong Valence Electrons Dependent and Logical Relations of Elemental Impurities in 2D Binary Semiconductor: a Case of GeP3 Monolayer from Ab Initio Studies Open

Suihao Zhang, Rui Li, Xiaonan Fu, Yu Zhao, Chunyao Niu , et al. · 2019

Strain-tunable electronic structure, optical response, and high electron mobility of Bi2O2Se crystals Open

Xiaoyu Huang, Chunyao Niu, Jinping Zhang, Aihua Wang, Yu Jia , et al. · 2019

Newly fabricated semiconductor Bi2O2Se films exhibit excellent electron transport and optical properties, with potential application in optoelectronics. In this work, using first-principle calculations combined with the modified Becke-John…

The ratio law of the structure evolution and stability for TinOm (n = 3–18, m = 1–2n) clusters Open

Hongbo Du, Yu Jia, Chunyao Niu, Kaige Hu, Haifeng Li , et al. · 2019

Nanofriction oscillation driven by sublayer indirect contact of silicon tip sliding on few-layer graphene Open

Shichang Yao, Jinping Zhang, Jianjun Wang, Aixia Mao, Chong Li , et al. · 2019

Nanofriction with few layers of graphene as lubrication is an interesting issue recently, and it provides a quite important guide for modeling the nanofriction properties of nanodevice. Based on the molecular dynamics (MD) simulations, nan…

Unusual pressure-induced electronic structure evolution in organometal halide perovskite predicted from first-principles Open

Fei Wang, Mengping Tan, Chong Li, Chunyao Niu, Xin Zhao · 2019

Hydrogen adsorption induced nanomagnetism at the Si(111)- surface Open

Xiaoyan Ren, Chunyao Niu, Seho Yi, Shunfang Li, Jun‐Hyung Cho · 2018

The creation of magnetism on non-magnetic semiconductor surfaces is of\nimportance for the realization of spintronics devices. Especially, the coupling\nof electron spins within quantum nanostructures can be utilized for\nnanomagnetism app…

Machine learning band gap and alignment of nitride semiconductors Open

Yang Huang, Fei Wang, Changyou Yu, Yuhuai Liu, Chong Li , et al. · 2018

Nitride has been drawing much attention due to its wide range of applications in optoelectronics and remains plenty of room for materials design and discovery. Here, a large set of nitrides have been designed, with their band gap and align…

Stable GaSe-Like Phosphorus Carbide Monolayer with Tunable Electronic and Optical Properties from Ab Initio Calculations Open

Xiaolin Cai, Zhili Zhu, Weiyang Yu, Chunyao Niu, Jianjun Wang , et al. · 2018

On the basis of density functional theory (DFT) calculations, we propose a stable two-dimensional (2D) monolayer phosphorus carbide (PC) with a GaSe-like structure, which has intriguing electronic and optical properties. Our calculated res…

First-principles prediction of oxygen diffusivity near the twin boundary in titanium Open

Mohammad Shahriar Hooshmand, Chunyao Niu, Dallas R. Trinkle, Maryam Ghazisaeidi · 2018

Multivalency-Driven Formation of Te-Based Monolayer Materials: A Combined First-Principles and Experimental study Open

Zhili Zhu, Xiaolin Cai, Seho Yi, Jinglei Chen, Yawei Dai , et al. · 2017

Contemporary science is witnessing a rapid expansion of the two-dimensional (2D) materials family, each member possessing intriguing emergent properties of fundamental and practical importance. Using the particle-swarm optimization method …

Strain induced quantum spin Hall insulator in monolayer β-BiSb from first-principles study Open

Weiyang Yu, Chunyao Niu, Zhili Zhu, Xiaolin Cai, Liwei Zhang , et al. · 2017

Topological insulator (TI) is a peculiar phase of matter exhibiting excellent quantum transport properties with potential applications in lower-power-consuming electronic devices.

Tellurene-a monolayer of tellurium from first-principles prediction Open

Zhili Zhu, Chengbin Cai, Chunyao Niu, C. Wang, Qilong Sun , et al. · 2016

A two dimensional (2D) Group-VI Te monolayer, tellurene, is predicted by using the first-principles calculations, which consists of planner four-membered and chair-like six-membered rings arranged alternately in a 2D lattice. The phonon sp…

H18 Carbon: A New Metallic Phase with sp2-sp3 Hybridized Bonding Network Open

Chunxiang Zhao, Chunyao Niu, Zhijie Qin, Xiao Ren, Jian-Tao Wang , et al. · 2016

Design and synthesis of three-dimensional metallic carbons are currently one of the hot issues in contemporary condensed matter physics because of their fascinating properties. Here, based on first-principles calculations, we discover a no…

Predicted monolayer group V semiconductor compounds: a first-principles study Open

Weiyang Yu, Zhili Zhu, Chunyao Niu, Chong Li, Jun‐Hyung Cho , et al. · 2015

To broaden the scope of layered group V semiconductors, we propose a class of phosphorene-like monolayer group V semiconductor compounds, such as PN, AsN, SbN, AsP, SbP, and SbAs with black-phosphorus-like $\alpha$ phase and blue-phosphoru…

Dilute magnetic semiconductor and half-metal behavior mediated by 3d transition-metal doped in black/blue phosphorene from first-principles calculations Open

Weiyang Yu, Zhili Zhu, Chunyao Niu, Chong Li, Jun‐Hyung Cho , et al. · 2015

Dilute magnetic semiconductor and half-metal behaviour mediated by 3d transition-metal doped in black/blue phosphorene Open

Weiyang Yu, Zhili Zhu, Chunyao Niu, Chong Li, Jun‐Hyung Cho , et al. · 2015

We present first-principles density-functional calculations for the structural, electronic, and magnetic properties of substitutional 3d transition metal (TM) impurities in two-dimensional black and blue phosphorenes. We find that the magn…

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