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Works (16)

First principles study of hydrogen storage on B-doped SiC monolayers through light transition metal atoms

International Journal of Hydrogen Energy
2024-04 | Journal article
Contributors: Francisco De Santiago; Lucia G. Arellano; Ivonne J. Hernández-Hernández; Alma R. Heredia; Álvaro Miranda; Alejandro Trejo; Luis A. Pérez; Miguel Cruz-Irisson
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DFT investigation of metal-decorated silicon carbide nanosheets for the adsorption of NH3

Materials Today Communications
2023-08 | Journal article
Contributors: Lucia G. Arellano; Brandom J. Cid; José E. Santana; Francisco De Santiago; Álvaro Miranda; Alejandro Trejo; Fernando Salazar; Luis A. Pérez; Miguel Cruz-Irisson
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Adsorption of urea on metal-functionalized Si nanowires for a potential uremia diagnosis: A DFT study

Materials Letters
2021 | Journal article
Contributors: Eduardo Santana, Jose; De Santiago, Francisco; Isabel Iturrios, Maria; Miranda, Alvaro; Antonio Perez, Luis; Cruz-Irisson, Miguel
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Alkali and transition metal atom-functionalized germanene for hydrogen storage: A DFT investigation

International Journal of Hydrogen Energy
2021 | Journal article
Contributors: Sosa, Akari Narayama; de Santiago, Francisco; Miranda, Alvaro; Trejo, Alejandro; Salazar, Fernando; Perez, Luis Antonio; Cruz-Irisson, Miguel
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Fluorinated porous silicon as sensor material for environmentally toxic gases: a first-principles study

Materials Advances
2021 | Journal article
Contributors: José Eduardo Santana; Francisco de Santiago; Álvaro Miranda; Luis Antonio Pérez; Fernando Salazar; Alejandro Trejo; Miguel Cruz-Irisson
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Hydrogen storage capacities of alkali and alkaline-earth metal atoms on SiC monolayer: A first-principles study

International Journal of Hydrogen Energy
2021 | Journal article
Contributors: Arellano, Lucia G.; de Santiago, Francisco; Miranda, Alvaro; Salazar, Fernando; Trejo, Alejandro; Perez, Luis A.; Cruz-Irisson, Miguel
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Silicon nanowires as acetone-adsorptive media for diabetes diagnosis

Applied Surface Science
2021 | Journal article
Contributors: De Santiago, Francisco; Eduardo Santana, Jose; Miranda, Alvaro; Antonio Perez, Luis; Rurali, Riccardo; Cruz-Irisson, Miguel
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Tunable thermal conductivity of ternary alloy semiconductors from first-principles

Journal of Physics D: Applied Physics
2021-08-19 | Journal article
Contributors: Francisco De Santiago; Martí Raya-Moreno; Álvaro Miranda; Miguel Cruz-Irisson; Xavier Cartoixà; Riccardo Rurali
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Theoretical modelling of porous silicon decorated with metal atoms for hydrogen storage

International Journal of Hydrogen Energy
2020 | Journal article
Contributors: Gonzalez, Israel; De Santiago, Francisco; Arellano, Lucia G.; Miranda, Alvaro; Trejo, Alejandro; Salazar, Fernando; Cruz-Irisson, Miguel
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Lithiation effects on the structural and electronic properties of Si nanowires as a potential anode material

Energy Storage Materials
2019 | Journal article
Contributors: De Santiago, F.; Gonzalez, J. E.; Miranda, A.; Trejo, A.; Salazar, F.; Perez, L. A.; Cruz-Irisson, M.
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Quasi-one-dimensional silicon nanostructures for gas molecule adsorption: a DFT investigation

Applied Surface Science
2019-05 | Journal article
Contributors: Francisco de Santiago; José Eduardo Santana; Álvaro Miranda; Alejandro Trejo; Rubén Vázquez-Medina; Luis Antonio Pérez; Miguel Cruz-Irisson
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Carbon monoxide sensing properties of B-, Al- and Ga-doped Si nanowires

Nanotechnology
2018 | Journal article
EID:

2-s2.0-85044829380

Contributors: De Santiago, F.; Trejo, A.; Miranda, A.; Salazar, F.; Carvajal, E.; Pérez, L.A.; Cruz-Irisson, M.
Source: Self-asserted source
Francisco de Santiago via Scopus - Elsevier
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First principles band gap engineering of [1 1 0] oriented 3C-SiC nanowires

Computational Materials Science
2018 | Journal article
EID:

2-s2.0-85032307331

Contributors: Cuevas, J.L.; de Santiago, F.; Ramírez, J.; Trejo, A.; Miranda, Á.; Pérez, L.A.; Cruz-Irisson, M.
Source: Self-asserted source
Francisco de Santiago via Scopus - Elsevier
grade
Preferred source (of 2)‎

Quantum confinement effects on the harmful-gas-sensing properties of silicon nanowires

International Journal of Quantum Chemistry
2018 | Journal article
EID:

2-s2.0-85052478451

Contributors: de Santiago, F.; Miranda, Á.; Trejo, A.; Salazar, F.; Carvajal, E.; Cruz-Irisson, M.; Pérez, L.A.
Source: Self-asserted source
Francisco de Santiago via Scopus - Elsevier
grade
Preferred source (of 2)‎

Band-gap engineering of halogenated silicon nanowires through molecular doping

Journal of Molecular Modeling
2017 | Journal article
EID:

2-s2.0-85032028091

Contributors: de Santiago, F.; Trejo, A.; Miranda, A.; Carvajal, E.; Pérez, L.A.; Cruz-Irisson, M.
Source: Self-asserted source
Francisco de Santiago via Scopus - Elsevier
grade
Preferred source (of 2)‎

Silicon nanowires as potential gas sensors: A density functional study

Sensors and Actuators, B: Chemical
2017 | Journal article
EID:

2-s2.0-85028274301

Contributors: Miranda, A.; de Santiago, F.; Pérez, L.A.; Cruz-Irisson, M.
Source: Self-asserted source
Francisco de Santiago via Scopus - Elsevier
grade
Preferred source (of 2)‎

Peer review (15 reviews for 7 publications/grants)

Review activity for International journal of hydrogen energy. (3)
Review activity for Journal of energy storage. (5)
Review activity for Journal of energy storage. (1)
Review activity for Nanotechnology. (3)
Review activity for Physica scripta. (1)
Review activity for Surfaces and interfaces. (1)
Review activity for The European physical journal. (1)