Fusion features of monocomponent parts in Janus-like nanoscale clusters under impacts of low- and ultra-low-energy Ar13 and Ar projectiles

被引:0
作者
Shyrokorad, Dmytro [1 ]
Kornich, Grygoriy [1 ,2 ]
Goncharov, Alexander [3 ,4 ]
Kolinko, Ivan [4 ]
机构
[1] Natl Univ Zaporizhzhia Polytech, Dept Syst Anal & Computat, Zaporizhzhia, Ukraine
[2] Univ Wurzburg, Fac Phys & Astron EP3, Wurzburg, Germany
[3] Slovak Univ Technol Bratislava, Inst Mat Sci, Trnava, Slovakia
[4] Sumy State Univ, Dept Appl Math & Complex Syst Modelling, Sumy, Ukraine
关键词
Janus clusters; core-shell; molecular dynamics; ion bombardment; MOLECULAR-DYNAMICS; CORE-SHELL; ATOMISTIC SIMULATION; NANOPARTICLES; NANOCLUSTERS; CRYSTAL; ALLOY; SCALE; BEAM;
D O I
10.1080/08927022.2024.2443571
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Molecular dynamics simulation of metastable Janus-like Ni-Al, Cu-Bi, and Cu-Au clusters with 195 atoms of each component is performed for 200 ps after impacts of Ar13 and Ar ions with different cases of initial energies from 25 to 300 eV. The boiling state of the components is achieved either at a high negative heat of mixing (Al, Ni-Al) or at a low boiling point of at least one of the components (Bi, Cu-Bi), provided that the Ar13 projectiles have the initial energy from 200 eV. In other cases, the Ni-Al cluster is also in a molten state, while the Cu-Bi cluster, as well as the Cu-Au cluster in all impact cases, may be in a molten state or have an atomic structure of varying degrees of the regularity of one/both component(s). The molten clusters form spatial core-shell distributions of the components, while in other cases different degrees and forms of their overlapping and eccentricity are possible during the time of simulation.
引用
收藏
页码:46 / 65
页数:20
相关论文
共 67 条
[1]   MANY-BODY POTENTIALS AND ATOMIC-SCALE RELAXATIONS IN NOBLE-METAL ALLOYS [J].
ACKLAND, GJ ;
VITEK, V .
PHYSICAL REVIEW B, 1990, 41 (15) :10324-10333
[2]   Ball-Cup, Janus, core-shell and disordered-alloy rhodium-gold nanoparticles: An atomistic simulation on structural stability [J].
Akbarzadeh, Hamed ;
Mehrjouei, Esmat ;
Abbaspour, Mohsen ;
Salemi, Sirous ;
Yaghoubi, Hamzeh ;
Hajizadeh, Zohreh .
COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 2022, 651
[3]  
Avasthi DK, 2010, CURR SCI INDIA, V98, P780
[4]   THE REPULSIVE WALL OF THE AR-AR INTERATOMIC POTENTIAL REEXAMINED [J].
AZIZ, RA ;
SLAMAN, MJ .
JOURNAL OF CHEMICAL PHYSICS, 1990, 92 (02) :1030-1035
[5]   MOLECULAR-DYNAMICS WITH COUPLING TO AN EXTERNAL BATH [J].
BERENDSEN, HJC ;
POSTMA, JPM ;
VANGUNSTEREN, WF ;
DINOLA, A ;
HAAK, JR .
JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (08) :3684-3690
[6]   Molecular Dynamics of Janus Nanodimers Dispersed in Lamellar Phases of a Block Copolymer [J].
Burgos-Marmol, J. Javier ;
Patti, Alessandro .
POLYMERS, 2021, 13 (09)
[7]   Kinetic approach to the cluster liquid-gas transition [J].
Calvo, F .
PHYSICAL REVIEW A, 2005, 71 (04)
[8]   Formation energetics/dynamics of icosahedral clusters in supercooled metallic liquids in the dynamic equilibrium regime: Gibbs free energy, entropy, enthalpy, and connection to coordination shells [J].
Chang, Tzu-Yi ;
Wang, Zhengming ;
Xu, Donghua .
JOURNAL OF MATERIALS RESEARCH, 2023, 38 (01) :179-186
[9]   Synthesis of Core-Shell Micro/Nanoparticles and Their Tribological Application: A Review [J].
Chen, Hao ;
Zhang, Lin ;
Li, Mengyu ;
Xie, Guoxin .
MATERIALS, 2020, 13 (20) :1-29
[10]   SOFT MATTER [J].
DEGENNES, PG .
SCIENCE, 1992, 256 (5056) :495-497