Small molecule gas adsorption onto blue phosphorene oxide layers

We report a first-principles study of the electronic and optical properties of BPO (Blue phosphorene oxide) and BPO-V (Blue phosphorene oxide with vacancy) with the adsorption of low molecular weight gases (CH4, CO2, CO, SO2, and O2). Blue phosphorene oxide -with and without vacancies- shows differe...

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Autores:
Tipo de recurso:
Fecha de publicación:
2020
Institución:
Universidad de Medellín
Repositorio:
Repositorio UDEM
Idioma:
eng
OAI Identifier:
oai:repository.udem.edu.co:11407/6013
Acceso en línea:
http://hdl.handle.net/11407/6013
Palabra clave:
Blue phosphorene oxide
Electronic properties
Gas adsorption
Optical properties
Calculations
Carbon dioxide
Electronic properties
Gas adsorption
Gases
Molecules
Optical properties
Adsorption energies
Ambient conditions
Electronic and optical properties
Energy of adsorption
First-principles study
Gas sensing applications
Low molecular weight
Physical adsorption
Gas sensing electrodes
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http://purl.org/coar/access_right/c_16ec