First-principles investigation of the structure and electronic properties of graphene toward Li adsorption

Generating pure spin current with spin-dependent Seebeck effect in ferromagnetic zigzag graphene nanoribbons

(2019) Yanhong Zhou et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

DFT study on electronic and optical properties of graphene modified by phosphorus

(2019) X S Dai et al.   Materials Research Express

Nanoporous carbon foam structures with excellent electronic properties predicted by first-principles studies

(2018) Shi-Zhang Chen et al.   CARBON

A local resonance mechanism for thermal rectification in pristine/branched graphene nanoribbon junctions

(2018) Xue-Kun Chen et al.   APPLIED PHYSICS LETTERS

DFT study on the electronic structure and optical properties of N, Al, and N-Al doped graphene

(2018) Xi Zhou et al.   APPLIED SURFACE SCIENCE

Theoretical investigation on the adsorption and diffusion of lithium-ion on and between graphene layers with size and defect effects

(2016) Yan-Zi Yu et al.   ADSORPTION SCIENCE & TECHNOLOGY

Functionalization-induced changes in the structural and physical properties of amorphous polyaniline: a first-principles and molecular dynamics study

(2016) X. P. Chen et al.   Scientific Reports

Energy-loss magnetic chiral dichroism study of epitaxial MnAs film on GaAs(001)

(2015) X. Fu et al.   APPLIED PHYSICS LETTERS

First-Principles Investigation of Adsorption and Diffusion of Ions on Pristine, Defective and B-doped Graphene

(2015) Wei Wan et al.   Materials

Adsorption and Diffusion of Li on Pristine and Defective Graphene

(2012) Xiaofeng Fan et al.   ACS Applied Materials & Interfaces

Adsorption of transition metal atoms (Co and Ni) on zigzag graphene nanoribbon

(2012) Zhiyong Wang et al.   APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING

Lithium Adsorption on Graphene: From Isolated Adatoms to Metallic Sheets

(2012) A. M. Garay-Tapia et al.   Journal of Chemical Theory and Computation

Synthesis and applications of graphene electrodes

(2012) Dolly Shin et al.   Carbon Letters

Large reversible capacity of high quality graphene sheets as an anode material for lithium-ion batteries

(2010) Peichao Lian et al.   ELECTROCHIMICA ACTA

Electron and vibrational spectroscopies using DFT, plane waves and pseudopotentials: CASTEP implementation

(2010) V. Milman et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Interaction of Melamine molecule with defected and defect free graphene nanoribbons

(2010) Zhiyong Wang et al.   PHYSICA B-CONDENSED MATTER

First-principles study on the enhancement of lithium storage capacity in boron doped graphene

(2009) Xianlong Wang et al.   APPLIED PHYSICS LETTERS

Li Storage Properties of Disordered Graphene Nanosheets

(2009) Dengyu Pan et al.   CHEMISTRY OF MATERIALS

The electronic properties of graphene

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

Superior Thermal Conductivity of Single-Layer Graphene

(2008) Alexander A. Balandin et al.   NANO LETTERS

Ultrahigh electron mobility in suspended graphene

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