国家/地区 China（2） Russia（2）
关键词 POTENTIAL ENERGY SURFACE（7）
出版物
出版时间 2015（2）
机构 DALIAN UNIV .（2）
作者 HAO C（2） OPENOV LA（2） PODLIVAEV AI（2）

Mechanism of Li storage on graphene nanoflakes: Density functional theory study

SURFACE SCIENCE

TACHIKAWA H

Theoretical study of the interaction between X (H, F) and graphene

MOLECULAR SIMULATION

JI M, REN SZ, HAO C, JIN HL, QIU JS

Comparison of performance of van der Waals-corrected exchange-correlation functionals for interlayer interaction in graphene and hexagonal boron nitride

COMPUTATIONAL MATERIALS SCIENCE

LEBEDEVA IV, LEBEDEV AV, POPOV AM, KNIZHNIK AA

The Interaction between Graphene and Oxygen Atom

OPEN PHYSICS

HAO YF, ZHAO XJ, SONG XD, LI HJ, ZHU XB, HAO C

Out-of-plane path of the Stone-Wales transformation in graphene

PHYSICS LETTERS A

PODLIVAEV AI, OPENOV LA

Real-time evolution of the buckled Stone-Wales defect in graphene

PHYSICA ELOWDIMENSIONAL SYSTEMS NANOSTRUCTURES

OPENOV LA, PODLIVAEV AI

Developing Potential Energy Surfaces for Graphene-Based 2D-3D Interfaces From Modified High-Dimensional Neural Networks for Applications in Energy Storage

JOURNAL OF ELECTROCHEMICAL ENERGY CONVERSION STORAGE

SHARMA V, DATTA D