国家/地区 Spain（3）
关键词 DENSITY FUNCTIONAL .（2）
出版物 PHYSICAL CHEMISTRY .（2）
出版时间 2018（4）
机构 UNIV AUTONOMA MADRID（4）
作者 POU P（4）

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

Substrate-induced enhancement of the chemical reactivity in metal-supported graphene

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

ROMEROMUNIZ C, MARTINRECIO A, POU P, GOMEZRODRIGUEZ JM, PEREZ R

Unveiling the atomistic mechanisms for oxygen intercalation in a strongly interacting graphene-metal interface

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

ROMEROMUNIZ C, MARTINRECIO A, POU P, GOMEZRODRIGUEZ JM, PEREZ R

Combining nitrogen substitutional defects and oxygen intercalation to control the graphene corrugation and doping level

CARBON

MARTINRECIO A, ROMEROMUNIZ C, POU P, PEREZ R, GOMEZRODRIGUEZ JM