位置：成果数据库 > 期刊 > 期刊详情页
氧气在掺杂石墨烯表面吸附的理论研究
  • ISSN号：1093-3263
  • 期刊名称：Journal of Molecular Graphics and Modelling
  • 时间：2013
  • 页码：126-132
  • 相关项目：缺陷石墨烯表面化学反应的第一性原理研究
作者： 赵景祥|
同期刊论文项目
缺陷石墨烯表面化学反应的第一性原理研究
期刊论文 23
同项目期刊论文
Catalyst-free achieving of controllable carbon doping of boron nitride nanosheets by CO molecules: a
Theoretical study on the encapsulation of Pd-3-based transition metal clusters inside boron nitride
Divacancy-assisted transition metal adsorption on the BN graphene and its interaction with hydrogen
Phosphorus-doped graphene and (8, 0) carbon nanotube: Structural, electronic, magnetic properties, a
Boosting sensitivity of boron nitride nanotube (BNNT) to nitrogen dioxide by Fe encapsulation
Silicon-doping in carbon nanotubes: formation energies, electronic structures, and chemical reactivi
Gas adsorption on silicene: A theoretical study
Stability and properties of the two-dimensional hexagonal boron nitride monolayer functionalized by
Modifying the electronic and magnetic properties of the boron nitride (BN) nanosheet by NHx (x=0, 1,
Theoretical study of the adsorption of CHO radicals on hexagonal boron nitride sheet: Structural and
Theoretical Study of the Deposition of Pt Clusters on Defective Hexagonal Boron Nitride (h-BN) Sheet
Theoretical prediction of the mechanisms for defect healing or oxygen doping in a hexagonal boron ni
Theoretical study of oxidation of monovacancies in hexagonal boron nitride (h-BN) sheet by oxygen mo
Theoretical study on Si-doped hexagonal boron nitride (h-BN) sheet: Electronic, magnetic properties,
Carbon-Doped Boron Nitride Nanosheet: An Efficient Metal-Free Electrocatalyst for the Oxygen Reducti
Si clusters/defective graphene composites as Li-ion batteries anode materials: A density functional
Fe– and Co–P4-embedded graphenes as electrocatalysts for the oxygen reduction reaction: theoretical
Theoretical Study on the Encapsulation of Li Atoms inside Boron Nitride Nanotubes: Physical Properti
Asymmetric functionalization as a promising route to open the band gap of silicene: A theoretical pr
Iron-embedded boron nitride nanosheet as a promising electrocatalyst for the oxygen reduction reacti