Ti3BN monolayer: the MXene-like material predicted by first-principles calculations

Sodium-Ion Intercalation Mechanism in MXene Nanosheets

(2016) Satoshi Kajiyama et al.   ACS Nano

Atomically Thin Boron Nitride: Unique Properties and Applications

(2016) Lu Hua Li et al.   ADVANCED FUNCTIONAL MATERIALS

Engineering Bandgaps of Monolayer MoS2and WS2on Fluoropolymer Substrates by Electrostatically Tuned Many-Body Effects

(2016) Bo Liu et al.   ADVANCED MATERIALS

A Honeycomb BeN2 Sheet with a Desirable Direct Band Gap and High Carrier Mobility

(2016) Cunzhi Zhang et al.   Journal of Physical Chemistry Letters

Zn2NF and Related Analogues of ZnO

(2016) Srinivasa Rao Lingampalli et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

FeB6 Monolayers: The Graphene-like Material with Hypercoordinate Transition Metal

(2016) Haijun Zhang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Two-Dimensional SiS Layers with Promising Electronic and Optoelectronic Properties: Theoretical Prediction

(2016) Ji-Hui Yang et al.   NANO LETTERS

TiC2: a new two-dimensional sheet beyond MXenes

(2016) Tianshan Zhao et al.   Nanoscale

Understanding the Low-Overpotential Production of CH4 from CO2 on Mo2C Catalysts

(2016) Seok Ki Kim et al.   ACS Catalysis

Investigations on Nb2C monolayer as promising anode material for Li or non-Li ion batteries from first-principles calculations

(2016) Junping Hu et al.   RSC Advances

An efficient counter electrode material for dye-sensitized solar cells—flower-structured 1T metallic phase MoS2

(2016) Wei Wei et al.   Journal of Materials Chemistry A

Plasma-induced, nitrogen-doped graphene-based aerogels for high-performance supercapacitors

(2016) Xue-Yu Zhang et al.   Light-Science & Applications

Surface group modification and carrier transport properties of layered transition metal carbides (Ti2CTx, T: –OH, –F and –O)

(2015) Shen Lai et al.   Nanoscale

Large-area high-quality 2D ultrathin Mo2C superconducting crystals

(2015) Chuan Xu et al.   NATURE MATERIALS

Silicene field-effect transistors operating at room temperature

(2015) Li Tao et al.   Nature Nanotechnology

First principles phonon calculations in materials science

(2015) Atsushi Togo et al.   SCRIPTA MATERIALIA

Ti3C2 MXene as a High Capacity Electrode Material for Metal (Li, Na, K, Ca) Ion Batteries

(2014) Dequan Er et al.   ACS Applied Materials & Interfaces

Be2C Monolayer with Quasi-Planar Hexacoordinate Carbons: A Global Minimum Structure

(2014) Yafei Li et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Single-Layer Group-III Monochalcogenide Photocatalysts for Water Splitting

(2013) Houlong L. Zhuang et al.   CHEMISTRY OF MATERIALS

MXene: A New Family of Promising Hydrogen Storage Medium

(2013) Qianku Hu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

New Two-Dimensional Niobium and Vanadium Carbides as Promising Materials for Li-Ion Batteries

(2013) Michael Naguib et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Intercalation and delamination of layered carbides and carbonitrides

(2013) Olha Mashtalir et al.   Nature Communications

Two-Dimensional Transition Metal Carbides

(2012) Michael Naguib et al.   ACS Nano

Breakdown of High-Performance Monolayer MoS2 Transistors

(2012) Dominik Lembke et al.   ACS Nano

Facile Ultrasonic Synthesis of CoO Quantum Dot/Graphene Nanosheet Composites with High Lithium Storage Capacity

(2012) Chengxin Peng et al.   ACS Nano

CALYPSO: A method for crystal structure prediction

(2012) Yanchao Wang et al.   COMPUTER PHYSICS COMMUNICATIONS

An effective structure prediction method for layered materials based on 2D particle swarm optimization algorithm

(2012) Yanchao Wang et al.   JOURNAL OF CHEMICAL PHYSICS

Are MXenes Promising Anode Materials for Li Ion Batteries? Computational Studies on Electronic Properties and Li Storage Capability of Ti3C2 and Ti3C2X2 (X = F, OH) Monolayer

(2012) Qing Tang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Two-Dimensional Nanocrystals Produced by Exfoliation of Ti3AlC2

(2011) Michael Naguib et al.   ADVANCED MATERIALS

Predicting Two-Dimensional Boron–Carbon Compounds by the Global Optimization Method

(2011) Xinyu Luo et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY