Native point defects in few-layer phosphorene

Black Phosphorus–Monolayer MoS2 van der Waals Heterojunction p–n Diode

(2014) Yexin Deng et al.   ACS Nano

Phosphorene: An Unexplored 2D Semiconductor with a High Hole Mobility

(2014) Han Liu et al.   ACS Nano

Electric field effect in ultrathin black phosphorus

(2014) Steven P. Koenig et al.   APPLIED PHYSICS LETTERS

Structural, electronic, and optical properties of GaInO3: A hybrid density functional study

(2014) V. Wang et al.   JOURNAL OF APPLIED PHYSICS

Bilayer Phosphorene: Effect of Stacking Order on Bandgap and Its Potential Applications in Thin-Film Solar Cells

(2014) Jun Dai et al.   Journal of Physical Chemistry Letters

Sources ofn-type conductivity in GaInO3

(2014) V Wang et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS

Tunable Transport Gap in Phosphorene

(2014) Saptarshi Das et al.   NANO LETTERS

Phosphorene excites materials scientists

(2014) Eugenie Samuel Reich   NATURE

Black phosphorus field-effect transistors

(2014) Likai Li et al.   Nature Nanotechnology

Electrons and holes in phosphorene

(2014) Pengke Li et al.   PHYSICAL REVIEW B

Strain-engineered direct-indirect band gap transition and its mechanism in two-dimensional phosphorene

(2014) Xihong Peng et al.   PHYSICAL REVIEW B

Layer-controlled band gap and anisotropic excitons in few-layer black phosphorus

(2014) Vy Tran et al.   PHYSICAL REVIEW B

Strain-Induced Gap Modification in Black Phosphorus

(2014) A. S. Rodin et al.   PHYSICAL REVIEW LETTERS

First-principles calculations for point defects in solids

(2014) Christoph Freysoldt et al.   REVIEWS OF MODERN PHYSICS

Electronic transport and device prospects of monolayer molybdenum disulphide grown by chemical vapour deposition

(2014) Wenjuan Zhu et al.   Nature Communications

High-mobility transport anisotropy and linear dichroism in few-layer black phosphorus

(2014) Jingsi Qiao et al.   Nature Communications

Band offsets and heterostructures of two-dimensional semiconductors

(2013) Jun Kang et al.   APPLIED PHYSICS LETTERS

Hopping transport through defect-induced localized states in molybdenum disulphide

(2013) Hao Qiu et al.   Nature Communications

Defects activated photoluminescence in two-dimensional semiconductors: interplay between bound, charged and free excitons

(2013) Sefaattin Tongay et al.   Scientific Reports

Calcium-decorated graphene for hydrogen storage: A van der Waals density functional study

(2012) V. Wang et al.   COMPUTATIONAL MATERIALS SCIENCE

Electronics and optoelectronics of two-dimensional transition metal dichalcogenides

(2012) Qing Hua Wang et al.   Nature Nanotechnology

Effect of van der Waals interactions on the structural and elastic properties of black phosphorus

(2012) S. Appalakondaiah et al.   PHYSICAL REVIEW B

The role of defects and doping in 2D graphene sheets and 1D nanoribbons

(2012) Humberto Terrones et al.   REPORTS ON PROGRESS IN PHYSICS

High-frequency, scaled graphene transistors on diamond-like carbon

(2011) Yanqing Wu et al.   NATURE

Single-layer MoS2 transistors

(2011) B. Radisavljevic et al.   Nature Nanotechnology

Assessing the accuracy of hybrid functionals in the determination of defect levels: Application to the As antisite in GaAs

(2011) Hannu-Pekka Komsa et al.   PHYSICAL REVIEW B

Hybrid functional study on structural and electronic properties of oxides

(2010) Sohee Park et al.   CURRENT APPLIED PHYSICS

Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections

(2010) Tomáš Bučko et al.   JOURNAL OF PHYSICAL CHEMISTRY A

High-speed graphene transistors with a self-aligned nanowire gate

(2010) Lei Liao et al.   NATURE

Graphene transistors

(2010) Frank Schwierz   Nature Nanotechnology

Defect levels through hybrid density functionals: Insights and applications

(2010) Audrius Alkauskas et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Accurate defect levels obtained from the HSE06 range-separated hybrid functional

(2010) Peter Deák et al.   PHYSICAL REVIEW B

Atomically ThinMoS2: A New Direct-Gap Semiconductor

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

Cu2ZnSnS4as a potential photovoltaic material: A hybrid Hartree-Fock density functional theory study

(2009) Joachim Paier et al.   PHYSICAL REVIEW B

FullyAb InitioFinite-Size Corrections for Charged-Defect Supercell Calculations

(2009) Christoph Freysoldt et al.   PHYSICAL REVIEW LETTERS

Hybrid functionals applied to extended systems

(2008) M Marsman et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

wannier90: A tool for obtaining maximally-localised Wannier functions

(2007) Arash A. Mostofi et al.   COMPUTER PHYSICS COMMUNICATIONS