2 citations · 2 across the 2 of their papers we have counts for
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Predicting BN analogue of 8-16-4 graphyne: \textit{In silico} insights into its structural, electronic, optical, and thermal transport properties
Isaac M. Félix, Jessé M. Pontes, Djardiel S. Gomes +5
The boron nitride (BN) analogue of 8-16-4 graphyne, termed SBNyne, is proposed for the first time. Its physical properties were explored using first-principles calculations and cla…
Structural and Electronic Properties of Amorphous Silicon and Germanium Monolayers and Nanotubes: A DFT Investigation
Raphael M. Tromer, Marcelo L. Pereira Junior, Luiz. A. Ribeiro Junior +1
A recent breakthrough has been achieved by synthesizing monolayer amorphous carbon (MAC), which introduces a material with unique optoelectronic properties. Here, we used ab initio…
On the mechanical, thermoelectric, and excitonic properties of Tetragraphene monolayer
Raphael M. Tromer, L. A. Ribeiro Júnior, Douglas S. Galvão +2
Two-dimensional carbon allotropes have attracted much attention due to their extraordinary optoelectronic and mechanical properties, which can be exploited for energy conversion an…
Hydrogen atom/molecule adsorption on 2D metallic porphyrin: A first-principles study
Raphael M. Tromer, Isaac M. Felix, Levi C. Felix +3
Hydrogen is a promising element for applications in new energy sources like fuel cells. One key issue for such applications is storing hydrogen. And, to improve storage capacity, u…
A DFT Study of the Electronic, Optical, and Mechanical Properties of a Recently Synthesized Monolayer Fullerene Network
Raphael M. Tromer, Luiz A. Ribeiro Junior, Douglas S. Galvão
Closely packed quasi-hexagonal and quasi-tetragonal crystalline phase of C molecules (named qHPC) was recently synthesized. Here, we used DFT simulations to investiga…