Mixed Valence Tin Oxides as Novel van der W aals Materials: Theoretical Predictions and Potential Applications

van der Waals forces in density functional theory: a review of the vdW-DF method

(2015) Kristian Berland et al.   REPORTS ON PROGRESS IN PHYSICS

Photocatalytic Water Splitting under Visible Light by Mixed-Valence Sn3O4

(2014) Maidhily Manikandan et al.   ACS Applied Materials & Interfaces

BaSi2as a promising low-cost, earth-abundant material with large optical activity for thin-film solar cells: A hybrid density functional study

(2014) Mukesh Kumar et al.   Applied Physics Express

Fabrication of p-n junction diode using SnO/SnO2 thin films and its device characteristics

(2014) R. Sathyamoorthy et al.   Electronic Materials Letters

Atomically thin p–n junctions with van der Waals heterointerfaces

(2014) Chul-Ho Lee et al.   Nature Nanotechnology

Anomalous nonadditive dispersion interactions in systems of three one-dimensional wires

(2014) Alston J. Misquitta et al.   PHYSICAL REVIEW B

First-principles calculations for point defects in solids

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

SnO2/Graphene Composites with Self-Assembled Alternating Oxide and Amine Layers for High Li-Storage and Excellent Stability

(2013) S. J. Richard Prabakar et al.   ADVANCED MATERIALS

Ambipolar doping in SnO

(2013) J. B. Varley et al.   APPLIED PHYSICS LETTERS

Band alignment in SnS thin-film solar cells: Possible origin of the low conversion efficiency

(2013) Lee A. Burton et al.   APPLIED PHYSICS LETTERS

Origin of the Bipolar Doping Behavior of SnO from X-ray Spectroscopy and Density Functional Theory

(2013) N. F. Quackenbush et al.   CHEMISTRY OF MATERIALS

Exploring Electro-active Functionality of Transparent Oxide Materials

(2013) Hideo Hosono   JAPANESE JOURNAL OF APPLIED PHYSICS

Comparative study of rutile and anatase SnO2 and TiO2: Band-edge structures, dielectric functions, and polaron effects

(2013) Maofeng Dou et al.   JOURNAL OF APPLIED PHYSICS

Analytic projection from plane-wave and PAW wavefunctions and application to chemical-bonding analysis in solids

(2013) Stefan Maintz et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Van der Waals heterostructures

(2013) A. K. Geim et al.   NATURE

Band alignment of rutile and anatase TiO2

(2013) David O. Scanlon et al.   NATURE MATERIALS

van der Waals bonding and the quasiparticle band structure of SnO from first principles

(2013) Kirsten Govaerts et al.   PHYSICAL REVIEW B

Electronic Structure and van der Waals Interactions in the Stability and Mobility of Point Defects in Semiconductors

(2013) Wang Gao et al.   PHYSICAL REVIEW LETTERS

Sn3O4: a novel heterovalent-tin photocatalyst with hierarchical 3D nanostructures under visible light

(2013) Yunhui He et al.   RSC Advances

Understanding the defect chemistry of tin monoxide

(2013) Jeremy P. Allen et al.   Journal of Materials Chemistry C

Graphite and Hexagonal Boron-Nitride have the Same Interlayer Distance. Why?

(2012) Oded Hod   Journal of Chemical Theory and Computation

Cross-sectional imaging of individual layers and buried interfaces of graphene-based heterostructures and superlattices

(2012) S. J. Haigh et al.   NATURE MATERIALS

Vertical field-effect transistor based on graphene–WS2 heterostructures for flexible and transparent electronics

(2012) Thanasis Georgiou et al.   Nature Nanotechnology

Density-Functional Theory with Screened van der Waals Interactions for the Modeling of Hybrid Inorganic-Organic Systems

(2012) Victor G. Ruiz et al.   PHYSICAL REVIEW LETTERS

Accurate and Efficient Method for Many-Body van der Waals Interactions

(2012) Alexandre Tkatchenko et al.   PHYSICAL REVIEW LETTERS

Field-Effect Tunneling Transistor Based on Vertical Graphene Heterostructures

(2012) L. Britnell et al.   SCIENCE

Crystal Structure and Electronic Structure of Red SnO

(2012) Jürgen Köhler et al.   ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE

How Evolutionary Crystal Structure Prediction Works—and Why

(2011) Artem R. Oganov et al.   ACCOUNTS OF CHEMICAL RESEARCH

Ambipolar Oxide Thin-Film Transistor

(2011) Kenji Nomura et al.   ADVANCED MATERIALS

Stereochemistry of post-transition metal oxides: revision of the classical lone pair model

(2011) Aron Walsh et al.   CHEMICAL SOCIETY REVIEWS

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Crystal Orbital Hamilton Population (COHP) Analysis As Projected from Plane-Wave Basis Sets

(2011) Volker L. Deringer et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Tin Monoxide: Structural Prediction from First Principles Calculations with van der Waals Corrections

(2011) Jeremy P. Allen et al.   Journal of Physical Chemistry C

Tunable metal–insulator transition in double-layer graphene heterostructures

(2011) L. A. Ponomarenko et al.   Nature Physics

Limits to doping in oxides

(2011) J. Robertson et al.   PHYSICAL REVIEW B

Band-gap transition induced by interlayer van der Waals interaction in MoS2

(2011) S. W. Han et al.   PHYSICAL REVIEW B

Van der Waals density functionals applied to solids

(2011) Jiří Klimeš et al.   PHYSICAL REVIEW B

Sputtering formation of p-type SnO thin-film transistors on glass toward oxide complimentary circuits

(2010) Hisato Yabuta et al.   APPLIED PHYSICS LETTERS

Semiconducting Sn3O4 nanobelts: Growth and electronic structure

(2010) O. M. Berengue et al.   JOURNAL OF APPLIED PHYSICS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Highly Enhanced Surface Area of Tin Oxide Nanocrystals

(2010) Yoshitake Masuda et al.   JOURNAL OF THE AMERICAN CERAMIC SOCIETY

Higher-accuracy van der Waals density functional

(2010) Kyuho Lee et al.   PHYSICAL REVIEW B

Superconductivity in SnO: A Nonmagnetic Analog to Fe-Based Superconductors?

(2010) M. K. Forthaus et al.   PHYSICAL REVIEW LETTERS

Ternary Pt/Rh/SnO2 electrocatalysts for oxidizing ethanol to CO2

(2009) A. Kowal et al.   NATURE MATERIALS

Tin monoxide as an s-orbital-based p-type oxide semiconductor: Electronic structures and TFT application

(2009) Yoichi Ogo et al.   PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE

Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data

(2009) Alexandre Tkatchenko et al.   PHYSICAL REVIEW LETTERS

p-channel thin-film transistor using p-type oxide semiconductor, SnO

(2008) Yoichi Ogo et al.   APPLIED PHYSICS LETTERS

Structure and Stability of a Homologous Series of Tin Oxides

(2008) Atsuto Seko et al.   PHYSICAL REVIEW LETTERS

Sources of Electrical Conductivity inSnO2

(2008) Abhishek Kumar Singh et al.   PHYSICAL REVIEW LETTERS

Topochemical Synthesis of Monometallic (Co2+–Co3+) Layered Double Hydroxide and Its Exfoliation into Positively Charged Co(OH)2 Nanosheets

(2007) Renzhi Ma et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION