4 papers
From Goldene to Noblene: exhaustive enumeration of the ordered Au-Ag-Cu monolayer alloys
Marcelo Lopes Pereira Junior
Two-dimensional metals became a laboratory reality with the isolation of Goldene, a gold sheet one atom thick released by chemical exfoliation, which raises the question of what al…
A Comparative Study of Structural Representations for 2D Materials: Insights from Dynamic Collision Fingerprint and Matminer
Raphael M. Tromer, Isaac M. Felix, Rafael Besse +2
In materials science, the selection of structural descriptors for machine learning protocols strongly influences predictive performance and the degree of physical interpretability…
How does Goldene Stack?
Marcelo Lopes Pereira, Emanuel J. A. dos Santos, Luiz Antonio Ribeiro +1
The recent synthesis of Goldene, a 2D atomic monolayer of gold, has opened new avenues in exploring novel materials. However, the question of when multilayer Goldene transitions in…
Predicting the Energetic Stabilization of Janus-MoSSe/AlN Heterostructures: A DFT Study
Ramiro M. dos Santos, Marcelo L. Pereira Junior, Luiz F. Roncaratti Junior +1
The packing mechanisms between Janus-MoSSe and Aluminum-Nitride (AlN) sheets were systematically investigated by using Density Function Theory calculations. Results show that the s…