国家/地区 Iran（3） China（2）
关键词 DENSITY FUNCTIONAL THEORY DFT（7）
出版物
出版时间 2020（7）
机构
作者

Tuning the electronic structure and thermodynamic properties of hybrid graphene-hexagonal boron nitride monolayer

FLATCHEM

OLANIYAN O, MOSKALEVA L, MAHADI R, IGUMBOR E, BELLO A

Unveiling the Synergistic Role of Oxygen Functional Groups in the Graphene-Mediated Oxidation of Glutathione

ACS APPLIED MATERIALS INTERFACES

WANG Y, BASDOGAN Y, ZHANG TY, LANKONE RS, WALLACE AN, FAIRBROTHER DH, KEITH JA, GILBERTSON LM

Properties of Bilayer Graphene Quantum Dots for Integrated Optics: An Ab Initio Study

PHOTONICS

GHANDCHI M, DARVISH G, MORAVVEJFARSHI MK

DFT/TDDFT Investigation of Electronic, Magnetic, and Optical Properties of Graphene Containing Different Values of Se Impurity

PHYSICS OF THE SOLID STATE

ARDAKANI YS, MORADI M

Nitrogen reduction reaction on small iron clusters supported by N-doped graphene: A theoretical study of the atomically precise active-site mechanism

NANO RESEARCH

CUI CN, ZHANG HC, LUO ZX

Transport Mechanism of B/P Codoped Armchair Graphene Nanoribbons

IEEE TRANSACTIONS ON ELECTRON DEVICES

LIU JX, SHAO QY, RUI CK, SHAO C

The topology impact on hydrogen storage capacity of Sc-decorated ever-increasing porous graphene

JOURNAL OF MOLECULAR MODELING

YASAREH F, KAZEMPOUR A, BEHJATMANESHARDAKANI R