First-principles prediction of charge mobility in carbon and organic nanomaterials

Electronic Structure and Carrier Mobility in Graphdiyne Sheet and Nanoribbons: Theoretical Predictions

(2011) Mengqiu Long et al.   ACS Nano

Patternable Solution-Crystallized Organic Transistors with High Charge Carrier Mobility

(2011) Kengo Nakayama et al.   ADVANCED MATERIALS

Thienoacene-Based Organic Semiconductors

(2011) Kazuo Takimiya et al.   ADVANCED MATERIALS

Two-dimensional deformation potential model of mobility in small molecule organic semiconductors

(2011) J. E. Northrup   APPLIED PHYSICS LETTERS

Ab initio LC-DFT study of graphene, multilayer graphenes and graphite

(2011) Pavel V. Avramov et al.   CHEMICAL PHYSICS LETTERS

Charge transport in high mobility molecular semiconductors: classical models and new theories

(2011) Alessandro Troisi   CHEMICAL SOCIETY REVIEWS

Mixed quantum-classical simulations of charge transport in organic materials: Numerical benchmark of the Su-Schrieffer-Heeger model

(2011) Linjun Wang et al.   JOURNAL OF CHEMICAL PHYSICS

Density-functional approaches to noncovalent interactions: A comparison of dispersion corrections (DFT-D), exchange-hole dipole moment (XDM) theory, and specialized functionals

(2011) Lori A. Burns et al.   JOURNAL OF CHEMICAL PHYSICS

High Capacity Hydrogen Storage in Ca Decorated Graphyne: A First-Principles Study

(2011) Chong Li et al.   Journal of Physical Chemistry C

High-Mobility Graphene Nanoribbons Prepared Using Polystyrene Dip-Pen Nanolithography

(2011) Yun-Sok Shin et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dianthra[2,3-b:2′,3′-f]thieno[3,2-b]thiophene (DATT): Synthesis, Characterization, and FET Characteristics of New π-Extended Heteroarene with Eight Fused Aromatic Rings

(2011) Kazuki Niimi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Inkjet printing of single-crystal films

(2011) Hiromi Minemawari et al.   NATURE

Interlayer interaction and relative vibrations of bilayer graphene

(2011) Irina V. Lebedeva et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Polaron transport in organic crystals: Temperature tuning of disorder effects

(2011) Frank Ortmann et al.   PHYSICAL REVIEW B

Electron transport properties of bilayer graphene

(2011) X. Li et al.   PHYSICAL REVIEW B

Electron-phonon coupling in bcc lithium

(2011) Timur Bazhirov et al.   PHYSICAL REVIEW B

Electron-phonon interactions in bilayer graphene

(2011) K. M. Borysenko et al.   PHYSICAL REVIEW B

Quasiparticle energies and excitonic effects of the two-dimensional carbon allotrope graphdiyne: Theory and experiment

(2011) Guangfu Luo et al.   PHYSICAL REVIEW B

Vibrational spectrum and electron-phonon coupling of doped solid picene from first principles

(2011) Alaska Subedi et al.   PHYSICAL REVIEW B

Intercalant and Intermolecular Phonon Assisted Superconductivity in K-Doped Picene

(2011) Michele Casula et al.   PHYSICAL REVIEW LETTERS

Electronic transport in two-dimensional graphene

(2011) S. Das Sarma et al.   REVIEWS OF MODERN PHYSICS

From computational discovery to experimental characterization of a high hole mobility organic crystal

(2011) Anatoliy N. Sokolov et al.   Nature Communications

Structures, stabilities and electronic properties of graphdiyne nanoribbons

(2011) Hongcun Bai et al.   RSC Advances

Solution-Processable Organic Single Crystals with Bandlike Transport in Field-Effect Transistors

(2010) Chuan Liu et al.   ADVANCED MATERIALS

Evaluation of Charge Mobility in Organic Materials: From Localized to Delocalized Descriptions at a First-Principles Level

(2010) Zhigang Shuai et al.   ADVANCED MATERIALS

A super resolution metalens with phase compensation mechanism

(2010) Changbao Ma et al.   APPLIED PHYSICS LETTERS

Architecture of graphdiyne nanoscale films

(2010) Guoxing Li et al.   CHEMICAL COMMUNICATIONS

Theoretical Characterization of the Air-Stable, High-Mobility Dinaphtho[2,3-b:2′3′-f]thieno[3,2-b]-thiophene Organic Semiconductor

(2010) Roel S. Sánchez-Carrera et al.   Journal of Physical Chemistry C

Interaction of Charge Carriers with Lattice Vibrations in Oligoacene Crystals from Naphthalene to Pentacene

(2010) Roel S. Sánchez-Carrera et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Scalable templated growth of graphene nanoribbons on SiC

(2010) M. Sprinkle et al.   Nature Nanotechnology

Charged impurity scattering in bilayer graphene

(2010) Shudong Xiao et al.   PHYSICAL REVIEW B

Charged impurity scattering and mobility in gated silicon nanowires

(2010) Martin P. Persson et al.   PHYSICAL REVIEW B

Thermoelectric transport properties of PbTe under pressure

(2010) Lanqing Xu et al.   PHYSICAL REVIEW B

Charge carrier scattering by defects in semiconductors

(2010) Vincenzo Lordi et al.   PHYSICAL REVIEW B

First-principles analysis of electron-phonon interactions in graphene

(2010) K. M. Borysenko et al.   PHYSICAL REVIEW B

Carbon-Based Field-Effect Transistors for Nanoelectronics

(2009) Marko Burghard et al.   ADVANCED MATERIALS

Reliability of Organic Field-Effect Transistors

(2009) Henning Sirringhaus   ADVANCED MATERIALS

Mobility Variations in Mono- and Multi-Layer Graphene Films

(2009) Kosuke Nagashio et al.   Applied Physics Express

Method of determining the exciton diffusion length using optical interference effect in Schottky diode

(2009) Suman Banerjee et al.   APPLIED PHYSICS LETTERS

First-principles calculations of electron mobilities in silicon: Phonon and Coulomb scattering

(2009) O. D. Restrepo et al.   APPLIED PHYSICS LETTERS

High-performance dinaphtho-thieno-thiophene single crystal field-effect transistors

(2009) Simon Haas et al.   APPLIED PHYSICS LETTERS

Computational methods for design of organic materials with high charge mobility

(2009) Linjun Wang et al.   CHEMICAL SOCIETY REVIEWS

Intrinsic mobility in graphene

(2009) R S Shishir et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Mechanical properties of graphene nanoribbons

(2009) Ricardo Faccio et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Electrochemical Gate-Controlled Charge Transport in Graphene in Ionic Liquid and Aqueous Solution

(2009) Fang Chen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theoretical Predictions of Size-Dependent Carrier Mobility and Polarity in Graphene

(2009) Meng-Qiu Long et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Charge Carrier Motion in Disordered Conjugated Polymers: A Multiscale Ab Initio Study

(2009) Nenad Vukmirović et al.   NANO LETTERS

A high-mobility electron-transporting polymer for printed transistors

(2009) He Yan et al.   NATURE

Origin of superconductivity in boron-doped silicon carbide from first principles

(2009) Jesse Noffsinger et al.   PHYSICAL REVIEW B

Screening-induced temperature-dependent transport in two-dimensional graphene

(2009) E. H. Hwang et al.   PHYSICAL REVIEW B

Nuclear tunneling effects of charge transport in rubrene, tetracene, and pentacene

(2009) Guangjun Nan et al.   PHYSICAL REVIEW B

How Perfect Can Graphene Be?

(2009) P. Neugebauer et al.   PHYSICAL REVIEW LETTERS

High-Mobility Few-Layer Graphene Field Effect Transistors Fabricated on Epitaxial Ferroelectric Gate Oxides

(2009) X. Hong et al.   PHYSICAL REVIEW LETTERS

The electronic properties of graphene

(2009) A. H. Castro Neto et al.   REVIEWS OF MODERN PHYSICS

Diffusive charge transport in graphene on SiO2

(2009) J.-H. Chen et al.   SOLID STATE COMMUNICATIONS

The role of acoustic phonon scattering in charge transport in organic semiconductors: a first-principles deformation-potential study

(2009) Ling Tang et al.   Science in China. Series B, Chemistry

Molecular Ordering of High-Performance Soluble Molecular Semiconductors and Re-evaluation of Their Field-Effect Transistor Characteristics

(2008) Takafumi Izawa et al.   ADVANCED MATERIALS

Electron transport and full-band electron-phonon interactions in graphene

(2008) Akin Akturk et al.   JOURNAL OF APPLIED PHYSICS

Charge patching method for electronic structure of organic systems

(2008) Nenad Vukmirović et al.   JOURNAL OF CHEMICAL PHYSICS

Role and effective treatment of dispersive forces in materials: Polyethylene and graphite crystals as test cases

(2008) Vincenzo Barone et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Electronic Structure of Disordered Conjugated Polymers: Polythiophenes

(2008) Nenad Vukmirović et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Armchair graphene nanoribbons: Electronic structure and electric-field modulation

(2008) Hassan Raza et al.   PHYSICAL REVIEW B

First-principles study of metal adatom adsorption on graphene

(2008) Kevin T. Chan et al.   PHYSICAL REVIEW B

Acoustic phonon scattering limited carrier mobility in two-dimensional extrinsic graphene

(2008) E. H. Hwang et al.   PHYSICAL REVIEW B

Phonon dispersions and vibrational properties of monolayer, bilayer, and trilayer graphene: Density-functional perturbation theory

(2008) Jia-An Yan et al.   PHYSICAL REVIEW B

IsLaFeAsO1−xFxan Electron-Phonon Superconductor?

(2008) L. Boeri et al.   PHYSICAL REVIEW LETTERS

Temperature-Dependent Transport in Suspended Graphene

(2008) K. I. Bolotin et al.   PHYSICAL REVIEW LETTERS

Giant Intrinsic Carrier Mobilities in Graphene and Its Bilayer

(2008) S. V. Morozov et al.   PHYSICAL REVIEW LETTERS

Room-Temperature All-Semiconducting Sub-10-nm Graphene Nanoribbon Field-Effect Transistors

(2008) Xinran Wang et al.   PHYSICAL REVIEW LETTERS

Chemically Derived, Ultrasmooth Graphene Nanoribbon Semiconductors

(2008) X. Li et al.   SCIENCE

Ultrahigh electron mobility in suspended graphene

(2008) K.I. Bolotin et al.   SOLID STATE COMMUNICATIONS

Theoretical study on non-covalent functionalization of armchair carbon nanotube by tetrathiafulvalene molecule

(2007) Niya Sa et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES