Ab-initio and Monte Carlo studies of magnetic and magnetocaloric properties of antiperovskite Mn3AlN

H Kerrai, A Zaim, M Kerouad - Computational Materials Science, 2024 - Elsevier
In this study, we systematically investigate the electronic, magnetic, and magnetocaloric
properties of Mn 3 AlN antiperovskite. This system is examined through first-principles …

The effects of Tb doping on the negative and positive magnetocaloric effects of Mn3Ga1− xTbxC (0.02≤ x≤ 0.05)

Y Wang, J Yan, Y Chen, Q Cui - Journal of Applied Physics, 2022 - pubs.aip.org
Generally, researchers focus on the great negative magnetocaloric effect (NMCE) rather
than the positive magnetocaloric effect (PMCE) in Mn 3 GaC. Here, we prepared Mn 3 Ga 1 …

Combining Ab Initio and Monte Carlo Methods to Study the Electronic, Magnetic, and Magnetocaloric Properties of Full-Heusler Material

S Amraoui, O Amhoud, B Boughazi, A Zaim… - Journal of Electronic …, 2024 - Springer
In this work, the full-Heusler GaFeCo 2 is studied using the first-principles method based on
density functional theory with the generalized gradient approximation (GGA and GGA+ U) …

Crystal Structure, Magnetic Phase Transitions and Magnetocaloric Effect of DyCo2−xGex Compounds

MF He, JC Xiong, L Ma, MX Wu, L Li, PX Yan… - Journal of Electronic …, 2024 - Springer
The crystal structure, magnetic phase transitions and magnetocaloric effect of DyCo2− x Ge
x (x= 0.0–0.2) compounds were studied. X-ray diffraction coupled with Rietveld analysis …

Pressure-dependent electronic, optical, and mechanical properties of antiperovskite X3NP (X= Ca, Mg): A first-principles study

C Feng, C Wu, X Luo, T Hu, F Chen, S Li… - Journal of …, 2023 - iopscience.iop.org
Hydrostatic pressure provides an efficient way to tune and optimize the properties of solid
materials without changing their composition. In this work, we investigate the electronic …

Structural, magnetic properties and magnetocaloric effect in antipervoskite compound Zn0.6NFe3.4

L Qian, X Kan, X Liu, S Feng, Q Lv, Y Li… - Journal of Materials …, 2022 - Springer
We systematically investigate the crystal structure, magnetic properties and magnetocaloric
effect (MCE) of antipervoskite compound Zn0. 6NFe3. 4. There is a ferromagnetic to …

Monte Carlo simulation of the coffee-ring effect on porous papers

Y Hwang, S Kim, C Lee, S Kwak, G Lee… - … and Computational Fluid …, 2023 - Springer
In this article, we present a mathematical model and numerical simulation of the coffee-ring
effect on porous papers. The numerical method is based on Monte Carlo simulation. The …