Investigating the structural, mechanical, elastic anisotropy and thermodynamic properties of Ta-C ultrahigh temperature ceramics via first-principles calculations DOI
Yong Pan, Zhijing Yang, Hui Zhang

et al.

Ceramics International, Journal Year: 2024, Volume and Issue: unknown

Published: Dec. 1, 2024

Language: Английский

Impact of TM elements (TM=Cr, Mn, Ti, Sc) doped on the electronic and mechanical properties of ZrAlNi intermetallics DOI
Kun Wang, Xudong Zhang, Feng Wang

et al.

Physics Letters A, Journal Year: 2025, Volume and Issue: unknown, P. 130215 - 130215

Published: Jan. 1, 2025

Language: Английский

Citations

9
First-principles investigations on the elastic properties, thermodynamic properties, electronic structures and anisotropy sound velocity of AlTi3N, AlTi2N, AlTi4N3 and Al2Ti3N2 ternary nitrides DOI
Kun Wang, Xudong Zhang, Feng Wang

et al.

Chemical Physics Letters, Journal Year: 2025, Volume and Issue: unknown, P. 141930 - 141930

Published: Feb. 1, 2025

Language: Английский

Citations

4
New insight into the structural, mechanical and thermodynamic properties of Mo2C MXene as the ultrahigh temperature ceramics DOI
Yong Pan, Lei Xu

Materials Today Chemistry, Journal Year: 2024, Volume and Issue: 42, P. 102449 - 102449

Published: Dec. 1, 2024

Language: Английский

Citations

12
The influence of Zr, Hf, Ti and Sc on the lattice vibration, mechanical, tensile stress-strain, electronic and optical properties of Al4C3 from first-principles calculations DOI
Dongyu Zheng, Kun Wang, Xudong Zhang

et al.

Chemical Physics Letters, Journal Year: 2025, Volume and Issue: unknown, P. 141935 - 141935

Published: Feb. 1, 2025

Language: Английский

Citations

1
The influence of Al concentration on the structural stability, electronic and optical properties of InN semiconductor from first-principles study DOI
Yong Pan,

Jiaxin Zhu

Computational Materials Science, Journal Year: 2024, Volume and Issue: 249, P. 113638 - 113638

Published: Dec. 24, 2024

Language: Английский

Citations

6
Effects of alloying elements (Ti, Zr, Ta, W) on the thermodynamic and elastic properties of HfC at high temperature and high pressure DOI
Chaoping Liang, Rui Wen, Weizhang Liang

et al.

International Journal of Refractory Metals and Hard Materials, Journal Year: 2025, Volume and Issue: unknown, P. 107058 - 107058

Published: Jan. 1, 2025

Language: Английский

Citations

0
The yttrium-based MAX Phases of Double Transition Metals YMAlX and (Y2/3M1/3)2AlX (M = Sc, Ti, Zr; X = C and N): An ab initio study DOI

Zeynab Amoudeh,

Peiman Amiri,

Amir Aliakbari

et al.

Ceramics International, Journal Year: 2025, Volume and Issue: unknown

Published: Feb. 1, 2025

Language: Английский

Citations

0
Noble metals improved the dehydrogenation, electronic and optical properties of TiH4 as the hydrogen storage material DOI
Tianrun Zheng

Journal of Energy Storage, Journal Year: 2025, Volume and Issue: 115, P. 115962 - 115962

Published: Feb. 27, 2025

Language: Английский

Citations

0
Comprehensive investigation of the physical properties of X5SiC2 (X = Cr, Mo, W) silicides: A first-principles approach for high-temperature applications DOI

Ahmad Waqar Aslam,

Athar Javed,

M.S. Akbar

et al.

Inorganic Chemistry Communications, Journal Year: 2025, Volume and Issue: unknown, P. 114312 - 114312

Published: March 1, 2025

Language: Английский

Citations

0
Investigating the structural, mechanical, elastic anisotropy and thermodynamic properties of Ta-C ultrahigh temperature ceramics via first-principles calculations DOI
Yong Pan, Zhijing Yang, Hui Zhang

et al.

Ceramics International, Journal Year: 2024, Volume and Issue: unknown

Published: Dec. 1, 2024

Language: Английский

Citations

0