国家/地区 Japan（2）
关键词 TRIANGULENE（4）
出版物
出版时间 2008（2）
机构 TOHOKU UNIV（2）
作者 CIMPOESU F（2） KAWAZOE Y（2） PHILPOTT MR（2）

On the radicalar properties of graphene fragments: double-hybrid DFT and perturbation theory approaches

THEORETICAL CHEMISTRY ACCOUNTS

SALVADOR MA, ANTONIO FCT, DA SILVA GD, BARTOLONI FH, ORESTES E, COUTINHONETO MD, HOMEMDEMELLO P

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

Bonding and Magnetism in High Symmetry Nano-Sized Graphene Molecules: Linear Acenes C4m+2H2m+4 (m=2,...25); Zigzag Hexangulenes C6m**2H6m (m=2,... 10); Crenelated Hexangulenes C6(3m**2-3m+1)H6(2m-1) (m=2,.6); Zigzag Triangulenes Cm**2+4m+1H6m (m=2,... 15)

MATERIALS TRANSACTIONS

PHILPOTT MR, CIMPOESU F, KAWAZOE Y

Recent progresses of quantum confinement in graphene quantum dots

FRONTIERS OF PHYSICS

LI SY, HE L