国家/地区 India（7） Japan（5） China（2）
关键词 GRAPHENE（15）
出版物 COMPUTATIONAL MATER.（3） CARBON（2） CHEMICAL PHYSICS（2）
JOURNAL OF CHEMICAL.（2）
出版时间 2012（4） 2009（3） 2017（3） 2008（2）
机构 TOHOKU UNIV（4） MADURAI KAMA.（2）
作者 KAWAZOE Y（15）

Non-regular hexagonal 2D carbon, an allotrope of graphene: a first-principles computational study

JOURNAL OF MOLECULAR MODELING

IYAKUTTI K, SURYA VJ, LAKSHMI I, RAJESWARAPALANICHAMY R, KAWAZOE Y

Adsorption and diffusion of F-2 molecules on pristine graphene

CHINESE PHYSICS B

YANG Y, LIU FC, KAWAZOE Y

Modification of graphene as active hydrogen storage medium by strain engineering

COMPUTATIONAL MATERIALS SCIENCE

SURYA VJ, IYAKUTTI K, MIZUSEKI H, KAWAZOE Y

Calcium-decorated graphene for hydrogen storage: A van der Waals density functional study

COMPUTATIONAL MATERIALS SCIENCE

WANG V, MIZUSEKI H, HE HP, CHEN G, ZHANG SL, KAWAZOE Y

Wigner crystallization of quadratically dispersing electrons in graphene

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

IYAKUTTI K, SURYA VJ, RAJESWARAPALANICHAMY R, KAWAZOE Y

Simulation of ripples in single layer graphene sheets and study of their vibrational and elastic properties

COMPUTATIONAL MATERIALS SCIENCE

IYAKUTTI K, SURYA VJ, EMELDA K, KAWAZOE Y

Polarization-induced switching effect in graphene nanoribbon edge-defect junction

JOURNAL OF CHEMICAL PHYSICS

YIN G, LIANG YY, JIANG F, CHEN H, WANG P, NOTE R, MIZUSEKI H, KAWAZOE Y

Geometry and bonding in the ground and lowest triplet state of D-6h symmetric crenellated edged C6[3m(m-1)+1]H6(2m-1) (m=2,...,6) graphene hydrocarbon molecules

CHEMICAL PHYSICS

PHILPOTT MR, KAWAZOE Y

A theoretical study on the interaction of aromatic amino acids with graphene and single walled carbon nanotube

JOURNAL OF CHEMICAL PHYSICS

RAJESH C, MAJUMDER C, MIZUSEKI H, KAWAZOE Y

Geometry, bonding and magnetism in planar triangulene graphene molecules with D-3h symmetry: ZigZag Cm..2+4m+1H3m+3 (m=2,...,15)

CHEMICAL PHYSICS

PHILPOTT MR, CIMPOESU F, KAWAZOE Y