国家/地区 Iran（7）
关键词 DFT（4） GRAPHENE（4） DENSITY FUNCTIONAL .（2）
出版物 MOLECULAR PHYSICS（7）
出版时间 2013（3）
机构 ISLAMIC AZAD.（3）
作者 PEYGHAN AA（2）

Density functional theory study on the adsorption of CO on X= (Mn and Tc)-doped graphene sheets in the presence and absence of static electric fields

MOLECULAR PHYSICS

REZAEISAMETI M, RAKHSHI M

Adsorption of H2S at Stone-Wales defects of graphene-like BC3: a computational study

MOLECULAR PHYSICS

PEYGHAN AA, SOLEYMANABADI H

Molecular dynamics simulation of gas adsorption on defected graphene

MOLECULAR PHYSICS

KHARATHA M, VAEZ A, ROZATIAN ASH

Electronic properties of BN-doped bilayer graphene and graphyne in the presence of electric field

MOLECULAR PHYSICS

MAJIDI R, KARAMI AR

DFT studies of Si- and Al-doping effects on the acetone sensing properties of BC3 graphene

MOLECULAR PHYSICS

MORADI M, NOEI M, PEYGHAN AA

N-doped graphene as a nanostructure adsorbent for carbon monoxide: DFT calculations

MOLECULAR PHYSICS

RAD AS, SHABESTARI SS, JAFARI SA, ZARDOOST MR, MIRABI A

Varistor characteristics of a nano- device containing graphene and oxidised graphene: verification by DFT plus NEGF

MOLECULAR PHYSICS

GHAVAMI B, RASTKAREBRAHIMZADEH A