Dynamical and structural properties of metallic liquid and glass Zr48Cu36Ag8Al8 alloy studied by molecular dynamics simulation
The structure and dynamics of the Zr 48 Cu 36 Ag 8 Al 8 alloy were investigated by
molecular dynamics simulation method using the embedded atom method (EAM) and tight …
molecular dynamics simulation method using the embedded atom method (EAM) and tight …
Hydrogen production mechanism and catalytic productivity of Ni-X@ g-C3N4 (X= precious and non-precious promoter metals) catalysts from KBH4 hydrolysis under …
In this study, the pressure effect of Ni-based catalysts added a second promoter metal to
increase of catalyst performance supported a graphite carbon nitride (gC 3 N 4) monolayer …
increase of catalyst performance supported a graphite carbon nitride (gC 3 N 4) monolayer …
An in-depth investigation of the microstructural evolution and dynamic properties of Zr77Rh23 metallic liquids and glasses: A molecular dynamics simulation study
M Celtek - Journal of Applied Physics, 2022 - pubs.aip.org
The microstructural evolutions and dynamic properties of the Zr 77 Rh 23 alloy during the
rapid cooling process have been studied by molecular dynamics (MD) simulations using …
rapid cooling process have been studied by molecular dynamics (MD) simulations using …
Molecular dynamics simulations of glass formation, structural evolution and diffusivity of the Pd-Si alloys during the rapid solidification process
The atomic structure, glass formation process and diffusion mechanism of Pd 100-x Si x (x=
10, 20, 30, 40 and 50) alloys during rapid solidification have been investigated by molecular …
10, 20, 30, 40 and 50) alloys during rapid solidification have been investigated by molecular …
Temperature, strain rate, and point vacancy dependent anisotropic mechanical behaviors of titanium carbide (Ti3C2) MXene: a molecular dynamics study
MXenes, one of the recognizable examples of modern 2D materials, are sparking
tremendous research interest because of their distinctive structural, electrical, and …
tremendous research interest because of their distinctive structural, electrical, and …
Computational study on a cobalt-based complex compound with amine ligand in X-doped (X= Co, Ru, Rh) Ca12Al14O33 functional material as an innovative catalyst …
Sodium borohydride (NaBH 4) has been generally studied as a source of hydrogen (H 2)
due to its important advantages with the development of support materials and catalysts for …
due to its important advantages with the development of support materials and catalysts for …
Crystallization analysis and determination of Avrami exponents during isothermal annealing and the effect of cooling rate on the evolution of the atomic structure of …
In this study, molecular dynamics simulations have been carried out to investigate the effect
of cooling rate on the atomic structure of the Pd 78 Si 16 Cu 6 alloy and the isothermal …
of cooling rate on the atomic structure of the Pd 78 Si 16 Cu 6 alloy and the isothermal …
Understanding the relationship between structural and dynamic properties in binary Mg-Al metallic liquids from molecular dynamics simulations
A Samiri, A Khmich, A Hasnaoui - Materials Today Communications, 2024 - Elsevier
The structure and dynamics of the Mg-Al alloy for the different compositions were
investigated using the embedded atom method (EAM) of molecular dynamics modeling. The …
investigated using the embedded atom method (EAM) of molecular dynamics modeling. The …
Molecular dynamics approach to efficient hydrogen generation process of Co-B catalysts decorating lanthanides (La, Ce, Pr, Nd) supported by flat-sheet and twisted …
In this study, the promoter role on highly efficient hydrogen generation productivity and H 2
formation mechanisms of Co-BX catalysts modified by rare earths (X= La, Ce, Pr, Nd) …
formation mechanisms of Co-BX catalysts modified by rare earths (X= La, Ce, Pr, Nd) …
[HTML][HTML] Structure effect of ENPs on mechanical properties of amorphous CuCo alloys
J Wang, Z Tian, Q Zheng, C Liang, M Fu… - Journal of Applied …, 2024 - pubs.aip.org
Nanoparticles play an important role in the properties of metallic glasses (MGs) due to their
diversified structures; however, their structure–property relationship is unclear. In this paper …
diversified structures; however, their structure–property relationship is unclear. In this paper …