The Investigation of Adsorption Behavior of Gas Molecules on FeN3-Doped Graphene
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- Type
- article
- Published
- 2022-01-29
- Cited by
- 6
- References
- 48
- Access
- Open access
- OpenAlex
- https://openalex.org/W4220852964
- Semantic Scholar
- https://api.semanticscholar.org/CorpusID:246425330
Keywords
Graphene, Adsorption, Dopant, Materials science, Molecule
References
- Unique Reactivity of Transition Metal Atoms Embedded in Graphene to CO, NO, O2 and O Adsorption: A First-Principles Investigation
- Nanoscience and technology : a collection of reviews from nature journals
- From ultrasoft pseudopotentials to the projector augmented-wave method
- Nanotube molecular wires as chemical sensors
- Generalized Gradient Approximation Made Simple.
- Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study
- Carbon dioxide gas sensor using a graphene sheet
- A first-principles study on gas sensing properties of graphene and Pd-doped graphene
- Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
- Rationale for mixing exact exchange with density functional approximations
- Mesoporous materials as gas sensors.
- VESTA 3 for three-dimensional visualization of crystal, volumetric and morphology data
- Adsorption of small molecules on graphene
- Molecular adsorption on graphene
- In situ cobalt-cobalt oxide/N-doped carbon hybrids as superior bifunctional electrocatalysts for hydrogen and oxygen evolution.
- Two-dimensional carbon nanostructures: Fundamental properties, synthesis, characterization, and potential applications
- Density functional theory calculations on the adsorption of formaldehyde and other harmful gases on pure, Ti-doped, or N-doped graphene sheets
- Reaction mechanisms for the CO oxidation on Au/CeO(2) catalysts: activity of substitutional Au(3+)/Au(+) cations and deactivation of supported Au(+) adatoms.
- Density functional theory investigation of the structure of SO2 and SO3 on Cu(111) and Ni(111)
- Graphene-based gas sensors
Cited by
- Adsorption Characteristics of Gas Molecules Adsorbed on Graphene Doped with Mn: A First Principle Study
- A theoretical study of the effect and mechanism of FeN_3-doped biochar for greenhouse gas mitigation
- First-principles study on α/β/γ-FeB6 monolayers as potential gas sensor for H2S and SO2
- Single-atom iron in zeolite Y for highly efficient acetylene semi-hydrogenation
- The distinct orbital Engineering for Enhanced CO Adsorption: The Role of Cu and Al Doping in MoTe2
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