Due to the growing demand for energy and impending environmental issues, fuel cells have
attracted significant attention as an alternative to conventional energy technologies. As cost …

Anion exchange membrane fuel cells (AEMFCs) have been hailed as a promising hydrogen
energy technology due to high energy conversion efficiency, zero carbon emission and the …

Using a basin-hopping global optimization method, an exhaustive global search of the
potential energy surface (PES) of trimetallic Ag-Au-Pt clusters is performed at the empirical …

The stable structures of Cu–Au–Pt clusters up to 147 atoms are optimized by using an
improved adaptive immune optimization algorithm (AIOA-IC method), in which several …

DFT calculations were employed to study the catalytic oxidation pathways of methanol on Pt
(111), Pt (200), Pt (220), and Pt (311) surface and PtNi surface by introducing Ni to four Pt …

The effect of systematic Ni atom addition on the chemical ordering properties of the
nanoalloys has been studied for PtNi@ Ag core–shell systems in which Ag atoms full occupy …

The structural motif transformations are vital for the catalytic performance of nanoalloys. A
growing body of evidence suggests that Pt-based binary and ternary heterogeneous …

In this study, the structural stabilities of trimetallic 55-atom icosahedral Cu-Au-Pt nanoalloys
with six different nanoalloy systems were investigated. Cu-Au-Pt nanoalloy systems were …

The core-shell morphologies of (PdPt) core Ag shell and (PdPt) core Au shell up to 147
atoms are investigated. The structural optimization of M–Pd–Pt (M= Ag or Au) is carried out …

In this research, we have simulated AgPd@ Pt nanoparticles with different core structures
(including the fcc, bcc, amorphous, phase-separated, and ordered structures) and different …