国家/地区
关键词 DFT（6）
出版物 MATERIALS RESEARCH EXPRESS（6）
出版时间 2019（3）
机构
作者

Adsorption of thiophene and SOx molecules on Cr-doped and Ti-doped graphene nanosheets: a DFT study

MATERIALS RESEARCH EXPRESS

YAN ZQ, BAI Y, SUN LJ

Studying metal-doped graphene nanosheet as a drug carrier for anticancer drug beta-lapachone using Density Functional Theory (DFT)

MATERIALS RESEARCH EXPRESS

KHODADADI Z, TORKIAN L

Predicted bandgap opening in highly-oriented wrinkles formed in chemical vapour deposition grown graphene

MATERIALS RESEARCH EXPRESS

DAWOOD OM, GUPTA RK, ALQAHTANI FH, MONTEVERDE U, KIM HY, SEXTON J, BRITNELL L, YOUNG RJ, HODSON NW, MISSOUS M, MIGLIORATO MA

Structural and vibrational study of graphene oxide via coronene based models: theoretical and experimental results

MATERIALS RESEARCH EXPRESS

DE MENDONCA JPA, DE LIMA AH, JUNQUEIRA GMA, QUIRINO WG, LEGNANI C, MACIEL IO, SATO F

First principles Raman study of boron and nitrogen doped planar T-graphene clusters

MATERIALS RESEARCH EXPRESS

BANDYOPADHYAY A, PAL P, CHOWDHURY S, JANA D

Theoretical investigation of the structural, optoelectronic, and the application of waste graphene oxide/polymer nanocomposite as a photosensitizer

MATERIALS RESEARCH EXPRESS

AGOBI AU, LOUIS H, EKPUNOBI AJ, UNIMUKE TO, IKEUBA AI, PEMBERE AMS, OZOEMENA CN