国家/地区 Argentina（4）
关键词 DFT（2）
出版物 ELECTROCHIMICA ACTA（3）
出版时间
机构 UNIV NACL CO.（3）
作者 LUQUE GL（4）

Modeling of substitutionally modified graphene structures to prevent the shuttle mechanism in lithium-sulfur batteries

ELECTROCHIMICA ACTA

VELEZ P, PARA ML, LUQUE GL, BARRACO D, LEIVA EPM

The origin of the catalysis of hydrogen peroxide reduction by functionalized graphene surfaces: A density functional theory study

ELECTROCHIMICA ACTA

LUQUE GL, ROJAS MI, RIVAS GA, LEIVA EPM

First-Principles studies of silicon underpotential deposition on defective graphene and its relevance for lithium-ion battery materials

ELECTROCHIMICA ACTA

URQUIZA ML, OTERO M, LUQUE GL, BARRACO D, LEIVA EPM

On the role of oxidized graphene interfaces in lithium sulfur batteries: Thermodynamic and kinetic aspects using density functional theory

APPLIED SURFACE SCIENCE

VELEZ P, ROJAS MD, VELASCO J, PARA ML, BARRACO D, LEIVA EPM, LUQUE GL