Christian A. Celaya

Adsorption of melphalan anticancer drug on C24, B12N12, B12C6N6, B6C12N12 and B6C6N12 nanocages: A comparative DFT study

Christian A. Celaya, Luis Felipe Hernández‐Ayala, Fernando Buendía et al. · Journal of Molecular Liquids · 2021 · 72 citations

Nanomedicine, Medicinal Chemistry, Comparative Dft Study +10

Tuning the band gap of M-doped titanate nanotubes (M = Fe, Co, Ni, and Cu): an experimental and theoretical study

Melissa Méndez-Galván, Christian A. Celaya, Oscar Andrés Jaramillo‐Quintero et al. · Nanoscale Advances · 2021 · 58 citations · Full text

Theoretical study of graphyne-γ doped with N atoms: The quest for novel catalytic materials

Christian A. Celaya, Jesús Muñiz, Luis Enrique Sansores · Fuel · 2018 · 43 citations

Materials Science, Graphene Nanomeshes, Graphene Quantum Dot +10

Exploring the potential of graphene oxide as a functional material to produce hydrocarbons via photocatalysis: Theory meets experiment

Christian A. Celaya, Cornelio Delesma, Patricio J. Valadés-Pelayo et al. · Fuel · 2020 · 20 citations

Materials Science, Graphene Nanomeshes, Engineering +10

Tailoring nanostructured materials based on <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline" id="d1e974" altimg="si104.svg"><mml:mi>γ</mml:mi></mml:math>-graphyne monolayers modified with Au heteroatoms for application in energy storage devices: A first principle study

Christian A. Celaya, Abdel Ghafour El Hachimi, Luis Enrique Sansores et al. · Applied Surface Science · 2022 · 20 citations

Materials Science, Math Xmlns, Nanosheet +10