国家/地区 Iran（12）
关键词 DFT（10） GRAPHENE（7） ADSORPTION（4）
MECHANICAL PROPERTI.（4） HEAVY METAL ATOM（3） YOUNG S MODULU（3）
DEFECT（2） DOS（2） ELECTRONIC PROPERTI.（2）
MULTISCALE（2）
出版物 MATERIALS CHEMISTRY.（2） SUPERLATTICES MICRO.（2）
出版时间 2019（3） 2020（3） 2017（2） 2018（2）
机构 UNIV MAZANDA.（5） ISLAMIC AZAD.（4）
作者 MASHHADZADEH AH（12）

Fracture toughness and crack propagation behavior of nanoscale beryllium oxide graphene-like structures: A molecular dynamics simulation analysis

ENGINEERING FRACTURE MECHANICS

DEHAGHANI MZ, MASHHADZADEH AH, SALMANKHANI A, KARAMI Z, HABIBZADEH S, GANJALI MR, SAEB MR

Experimental and multiscale quantum mechanics modeling of the mechanical properties of PVC/graphene nanocomposite

JOURNAL OF COMPOSITE MATERIALS

MASHHADZADEH AH, FEREIDOON A, AHANGARI MG

Removal of methylmercaptan pollution using Ni and Pt-decorated graphene: an ab-initio DFT study

JOURNAL OF SULFUR CHEMISTRY

SHAHMORADI A, AHANGARI MG, JAHANSHAHI M, MIRGHOREISHI M, FATHI E, MASHHADZADEH AH

Effect of various defects on mechanical and electronic properties of zinc oxide graphene-like structure: A DFT study

VACUUM

AHANGARI MG, MASHHADZADEH AH, FATHALIAN M, DADRASI A, ROSTAMIYAN Y, MALLAHI A

Density Functional Theory Study on the Mechanical Properties and Interlayer Interactions of Multi-layer Graphene: Carbonic, Silicon-Carbide and Silicene Graphene-like Structures

SILICON

AHANGARI MG, SALMANKHANI A, IMANI AH, SHAHAB N, MASHHADZADEH AH

Theoretical studies on the mechanical and electronic properties of 2D and 3D structures of Beryllium-Oxide graphene and graphene nanobud

APPLIED SURFACE SCIENCE

MASHHADZADEH AH, AHANGARI MG, DADRASI A, FATHALIAN M

DFT study of Ni, Cu, Cd and Ag heavy metal atom adsorption onto the surface of the zinc-oxide nanotube and zinc-oxide graphene-like structure

MATERIALS CHEMISTRY PHYSICS

MASHHADZADEH AH, FATHALIAN M, AHANGARI MG, SHAHAVI MH

Density functional theory study of adsorption properties of non-carbon, carbon and functionalized graphene surfaces towards the zinc and lead atoms

PHYSICA ELOWDIMENSIONAL SYSTEMS NANOSTRUCTURES

MASHHADZADEH AH, AHANGARI MG, SALMANKHANI A, FATALIYAN M

Interlayer interaction and mechanical properties in multi-layer graphene, Boron-Nitride, Aluminum-Nitride and Gallium-Nitride graphene-like structure: A quantum-mechanical DFT study

SUPERLATTICES MICROSTRUCTURES

AHANGARI MG, FEREIDOON A, MASHHADZADEH AH

Combining density functional theory-finite element multi-scale method to predict mechanical properties of polypropylene/graphene nanocomposites: Experimental study

MATERIALS CHEMISTRY PHYSICS

MASHHADZADEH AH, FEREIDOON A, AHANGARI MG