2DMatPedia, an open computational database of two-dimensional materials from top-down and bottom-up approaches

Massless Dirac Fermions in ZrTe2 Semimetal Grown on InAs(111) by van der Waals Epitaxy

(2018) Polychronis Tsipas et al.   ACS Nano

Persistent Charge-Density-Wave Order in Single-Layer TaSe2

(2018) Hyejin Ryu et al.   NANO LETTERS

Unconventional superconductivity in magic-angle graphene superlattices

(2018) Yuan Cao et al.   NATURE

Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds

(2018) Nicolas Mounet et al.   Nature Nanotechnology

InSe monolayer: synthesis, structure and ultra-high second-harmonic generation

(2018) Jiadong Zhou et al.   2D Materials

The computational 2D materials database: High-throughput modeling and discovery of atomically thin crystals

(2018) Sten Haastrup et al.   2D Materials

Computational screening of high-performance optoelectronic materials using OptB88vdW and TB-mBJ formalisms

(2018) Kamal Choudhary et al.   Scientific Data

PdSe2: Pentagonal Two-Dimensional Layers with High Air Stability for Electronics

(2017) Akinola D. Oyedele et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Rapid Flame Synthesis of Atomically Thin MoO3 down to Monolayer Thickness for Effective Hole Doping of WSe2

(2017) Lili Cai et al.   NANO LETTERS

Data Mining for New Two- and One-Dimensional Weakly Bonded Solids and Lattice-Commensurate Heterostructures

(2017) Gowoon Cheon et al.   NANO LETTERS

Chemical vapor deposition of trigonal prismatic NbS2 monolayers and 3R-polytype few-layers

(2017) Xinsheng Wang et al.   Nanoscale

Structural phase transition in monolayer MoTe2 driven by electrostatic doping

(2017) Ying Wang et al.   NATURE

Discovery of intrinsic ferromagnetism in two-dimensional van der Waals crystals

(2017) Cheng Gong et al.   NATURE

Layer-dependent ferromagnetism in a van der Waals crystal down to the monolayer limit

(2017) Bevin Huang et al.   NATURE

Edge conduction in monolayer WTe2

(2017) Zaiyao Fei et al.   Nature Physics

Topology-Scaling Identification of Layered Solids and Stable Exfoliated 2D Materials

(2017) Michael Ashton et al.   PHYSICAL REVIEW LETTERS

Flexible Device Applications of 2D Semiconductors

(2017) Li Gao   Small

Synthesis of 2D Layered BiI3 Nanoplates, BiI3 /WSe2 van der Waals Heterostructures and Their Electronic, Optoelectronic Properties

(2017) Jia Li et al.   Small

Vertically aligned two-dimensional SnS2 nanosheets with a strong photon capturing capability for efficient photoelectrochemical water splitting

(2017) Guangbo Liu et al.   Journal of Materials Chemistry A

High-throughput Identification and Characterization of Two-dimensional Materials using Density functional theory

(2017) Kamal Choudhary et al.   Scientific Reports

Ternary Ta2NiSe5Flakes for a High-Performance Infrared Photodetector

(2016) Liang Li et al.   ADVANCED FUNCTIONAL MATERIALS

Extraordinarily Strong Interlayer Interaction in 2D Layered PtS2

(2016) Yuda Zhao et al.   ADVANCED MATERIALS

Spin dynamics, electronic, and thermal transport properties of two-dimensional CrPS4 single crystal

(2016) Q. L. Pei et al.   JOURNAL OF APPLIED PHYSICS

Nanoscale Domain Structure and Defects in a 2-D WO3 Layer on Pd(100)

(2016) N. Doudin et al.   Journal of Physical Chemistry C

Experimental Demonstration of an Electride as a 2D Material

(2016) Daniel L. Druffel et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Magnetic Properties of Restacked 2D Spin 1/2 honeycomb RuCl3 Nanosheets

(2016) Daniel Weber et al.   NANO LETTERS

Recent advances in 2D materials for photocatalysis

(2016) Bin Luo et al.   Nanoscale

Reproducibility in density functional theory calculations of solids

(2016) K. Lejaeghere et al.   SCIENCE

Ultrathin nanosheets of CrSiTe3: a semiconducting two-dimensional ferromagnetic material

(2016) Ming-Wei Lin et al.   Journal of Materials Chemistry C

Tunable Electronic Structures in Wrinkled 2D Transition-Metal-Trichalcogenide (TMT) HfTe3Films

(2016) Yu-Qi Wang et al.   Advanced Electronic Materials

2D Tin Monoxide-An Unexplored p-Type van der Waals Semiconductor: Material Characteristics and Field Effect Transistors

(2016) Kachirayil J. Saji et al.   Advanced Electronic Materials

Raman Spectra of ZrS2 and ZrSe2 from Bulk to Atomically Thin Layers

(2016) Samuel Mañas-Valero et al.   Applied Sciences-Basel

Valleytronics in 2D materials

(2016) John R. Schaibley et al.   Nature Reviews Materials

Two-dimensional semiconductors for transistors

(2016) Manish Chhowalla et al.   Nature Reviews Materials

Weak Van der Waals Stacking, Wide-Range Band Gap, and Raman Study on Ultrathin Layers of Metal Phosphorus Trichalcogenides

(2015) Ke-zhao Du et al.   ACS Nano

Atomically Thin Arsenene and Antimonene: Semimetal-Semiconductor and Indirect-Direct Band-Gap Transitions

(2015) Shengli Zhang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

FireWorks: a dynamic workflow system designed for high-throughput applications

(2015) Anubhav Jain et al.   CONCURRENCY AND COMPUTATION-PRACTICE & EXPERIENCE

Computational 2D Materials Database: Electronic Structure of Transition-Metal Dichalcogenides and Oxides

(2015) Filip A. Rasmussen et al.   Journal of Physical Chemistry C

High-Yield Exfoliation of Ultrathin Two-Dimensional Ternary Chalcogenide Nanosheets for Highly Sensitive and Selective Fluorescence DNA Sensors

(2015) Chaoliang Tan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Controlled Synthesis of ZrS2 Monolayer and Few Layers on Hexagonal Boron Nitride

(2015) Mei Zhang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

van der Waals Epitaxial Growth of Atomically Thin Bi2Se3 and Thickness-Dependent Topological Phase Transition

(2015) Shuigang Xu et al.   NANO LETTERS

Monolayer PtSe2, a New Semiconducting Transition-Metal-Dichalcogenide, Epitaxially Grown by Direct Selenization of Pt

(2015) Yeliang Wang et al.   NANO LETTERS

Flexible n-type thermoelectric materials by organic intercalation of layered transition metal dichalcogenide TiS 2

(2015) Chunlei Wan et al.   NATURE MATERIALS

Strongly enhanced charge-density-wave order in monolayer NbSe2

(2015) Xiaoxiang Xi et al.   Nature Nanotechnology

Arsenene: Two-dimensional buckled and puckered honeycomb arsenic systems

(2015) C. Kamal et al.   PHYSICAL REVIEW B

Understanding catalysis in a multiphasic two-dimensional transition metal dichalcogenide

(2015) Stanley S. Chou et al.   Nature Communications

Photoluminescence of two-dimensional GaTe and GaSe films

(2015) O Del Pozo-Zamudio et al.   2D Materials

The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies

(2015) Scott Kirklin et al.   npj Computational Materials

HfSe2 Thin Films: 2D Transition Metal Dichalcogenides Grown by Molecular Beam Epitaxy

(2014) Ruoyu Yue et al.   ACS Nano

Direct Chemical Vapor Deposition Growth of WS2 Atomic Layers on Hexagonal Boron Nitride

(2014) Mitsuhiro Okada et al.   ACS Nano

Fabrication of atomic single layer graphitic-C3N4 and its high performance of photocatalytic disinfection under visible light irradiation

(2014) Huanxin Zhao et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

An atlas of two-dimensional materials

(2014) Pere Miró et al.   CHEMICAL SOCIETY REVIEWS

Layer-dependent electrical and optoelectronic responses of ReSe2 nanosheet transistors

(2014) Shengxue Yang et al.   Nanoscale

Phase-engineered low-resistance contacts for ultrathin MoS2 transistors

(2014) Rajesh Kappera et al.   NATURE MATERIALS

Black phosphorus field-effect transistors

(2014) Likai Li et al.   Nature Nanotechnology

Epitaxial growth of silicene on ultra-thin Ag(111) films

(2014) Junki Sone et al.   NEW JOURNAL OF PHYSICS

Germanene: a novel two-dimensional germanium allotrope akin to graphene and silicene

(2014) M E Dávila et al.   NEW JOURNAL OF PHYSICS

Two-dimensional time-reversal-invariant topological superconductivity in a doped quantum spin-Hall insulator

(2014) Jing Wang et al.   PHYSICAL REVIEW B

Two-dimensional flexible nanoelectronics

(2014) Deji Akinwande et al.   Nature Communications

Monolayer behaviour in bulk ReS2 due to electronic and vibrational decoupling

(2014) Sefaattin Tongay et al.   Nature Communications

Stability and Exfoliation of Germanane: A Germanium Graphane Analogue

(2013) Elisabeth Bianco et al.   ACS Nano

Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)

(2013) James E. Saal et al.   JOM

Single-Layer Single-Crystalline SnSe Nanosheets

(2013) Lun Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Van der Waals heterostructures

(2013) A. K. Geim et al.   NATURE

Photoluminescence emission and Raman response of monolayer MoS_2, MoSe_2, and WSe_2

(2013) Philipp Tonndorf et al.   OPTICS EXPRESS

Commentary: The Materials Project: A materials genome approach to accelerating materials innovation

(2013) Anubhav Jain et al.   APL Materials

AFLOW: An automatic framework for high-throughput materials discovery

(2012) Stefano Curtarolo et al.   COMPUTATIONAL MATERIALS SCIENCE

Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis

(2012) Shyue Ping Ong et al.   COMPUTATIONAL MATERIALS SCIENCE

Stable, Single-Layer MX2 Transition-Metal Oxides and Dichalcogenides in a Honeycomb-Like Structure

(2012) C. Ataca et al.   Journal of Physical Chemistry C

Ultrathin V2O5nanosheet cathodes: realizing ultrafast reversible lithium storage

(2012) Xianhong Rui et al.   Nanoscale

van der Waals Bonding in Layered Compounds from Advanced Density-Functional First-Principles Calculations

(2012) T. Björkman et al.   PHYSICAL REVIEW LETTERS

Single-layer MoS2 transistors

(2011) B. Radisavljevic et al.   Nature Nanotechnology

Crystallography Open Database (COD): an open-access collection of crystal structures and platform for world-wide collaboration

(2011) Saulius Gražulis et al.   NUCLEIC ACIDS RESEARCH

Van der Waals density functionals applied to solids

(2011) Jiří Klimeš et al.   PHYSICAL REVIEW B

High-throughput electronic band structure calculations: Challenges and tools

(2010) Wahyu Setyawan et al.   COMPUTATIONAL MATERIALS SCIENCE

Few-Layer Nanoplates of Bi2Se3and Bi2Te3with Highly Tunable Chemical Potential

(2010) Desheng Kong et al.   NANO LETTERS

Atomically ThinMoS2: A New Direct-Gap Semiconductor

(2010) Kin Fai Mak et al.   PHYSICAL REVIEW LETTERS

Monolayer honeycomb structures of group-IV elements and III-V binary compounds: First-principles calculations

(2009) H. Şahin et al.   PHYSICAL REVIEW B

Efficient Implementation of a van der Waals Density Functional: Application to Double-Wall Carbon Nanotubes

(2009) Guillermo Román-Pérez et al.   PHYSICAL REVIEW LETTERS

Control of Graphene's Properties by Reversible Hydrogenation: Evidence for Graphane

(2009) D. C. Elias et al.   SCIENCE

The two-dimensional phase of boron nitride: Few-atomic-layer sheets and suspended membranes

(2008) D. Pacilé et al.   APPLIED PHYSICS LETTERS

Li−Fe−P−O2 Phase Diagram from First Principles Calculations

(2008) Shyue Ping Ong et al.   CHEMISTRY OF MATERIALS

Covalent radii revisited

(2008) Beatriz Cordero et al.   DALTON TRANSACTIONS