国家/地区 Japan（17）
关键词 DENSITY FUNCTIONAL THEORY（17）
出版物 JOURNAL OF THE PHYS.（2） PHYSICA STATUS SOLI.（2）
出版时间 2011（3） 2012（2） 2013（2） 2014（2） 2021（2）
机构 HOKKAIDO UNI.（2） IWATE UNIV（2） OSAKA UNIV（2） TOKYO INST T.（2）
作者 HASEGAWA M（2） NISHIDATE K（2） OKADA S（2）

Hybridization versus sublattice symmetry breaking in the band gap opening in graphene on Ni(111): A first-principles study

SURFACE SCIENCE

NISHIDATE K, TANIBAYASHI S, MATSUKAWA M, HASEGAWA M

High-accuracy large-scale DFT calculations using localized orbitals in complex electronic systems: the case of graphene-metal interfaces

JOURNAL OF PHYSICSCONDENSED MATTER

ROMEROMUNIZ C, NAKATA A, POU P, BOWLER DR, MIYAZAKI T, PEREZ R

DFT study of anatase-derived TiO2 nanosheets/graphene hybrid materials

PHYSICA STATUS SOLIDI BBASIC SOLID STATE PHYSICS

MASUDA Y, GIORGI G, YAMASHITA K

Structures and electronic states of fluorinated graphene

SOLID STATE SCIENCES

TACHIKAWA H, IYAMA T

Rearrangement of pi-Electron Network and Switching of Edge-Localized pi State in Reduced Graphene Oxide

ACS NANO

FUJII S, ENOKI T

Density Functional Theory Study on the Reaction of Finite-Sized Graphene with Methyne

MOLECULAR CRYSTALS LIQUID CRYSTALS

TAKADA T, KOMATSU Y, TAKAGI T

Electronic Properties of Graphene/h-BN Bilayer Superlattices

JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

SAKAI Y, SAITO S

Platinum Clusters on Vacancy-Type Defects of Nanometer-Sized Graphene Patches

MOLECULES

YUMURA T, AWANO T, KOBAYASHI H, YAMABE T

Theoretical study on singlet oxygen adsorption onto surface of graphene-like aromatic hydrocarbon molecules

POLYHEDRON

KINOSHITA K, SAITO T, ITO A, KAWAKAMI T, KITAGAWA Y, YAMANAKA S, YAMAGUCHI K, OKUMURA M

First-principles modeling of the interactions of iron impurities with graphene and graphite

PHYSICA STATUS SOLIDI BBASIC SOLID STATE PHYSICS

BOUKHVALOV DW