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Bao-Tian Wang

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Articles 35
Citations 74
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Recent Articles
1.
Liu P, Li X, Li J, Zhu J, Tong Z, Kofu M, et al.
Natl Sci Rev . 2024 Nov; 11(12):nwae216. PMID: 39554237
Crystalline solids exhibiting inherently low lattice thermal conductivity ( ) are of great importance in applications such as thermoelectrics and thermal barrier coatings. However, cannot be arbitrarily low and is...
2.
Ma J, Zheng J, Chen Y, Ren Q, Zhang J, Wang B
Phys Chem Chem Phys . 2024 Aug; 26(32):21801-21809. PMID: 39101765
Lead-free halide perovskites have recently garnered significant attention due to their rich structural diversity and exceptionally ultralow lattice thermal conductivity (). Here, we employ first-principles calculations in conjunction with self-consistent...
3.
Ma J, Han X, Cai X, Qiu R, Eriksson O, Zhang P, et al.
Materials (Basel) . 2023 Apr; 16(7). PMID: 37048917
High-temperature body-centered cubic (BCC) γ-U is effectively stablized by γ-(U,Zr) alloys that also make it feasible to use it as a nuclear fuel. However, relatively little research has focused on...
4.
Wu K, Zhao E, Ran P, Yin W, Zhang Z, Wang B, et al.
Small . 2023 Feb; 19(18):e2300419. PMID: 36725302
All-Mn-based Li-rich cathodes Li MnO have attracted extensive attention because of their cost advantage and ultrahigh theoretical capacity. However, the unstable anionic redox reaction (ARR), which involves irreversible oxygen releases,...
5.
Liu H, Lu H, Jiao N, Zheng M, Li Y, Yang L, et al.
Phys Chem Chem Phys . 2022 Dec; 25(1):580-589. PMID: 36484277
Theoretically and experimentally, MXenes consisting of Mo and C have aroused much interest due to superconductivity in their films and even monolayer forms. Here, based on first-principles calculations, we systematically...
6.
Huang S, Ma J, Lai K, Zhang C, Yin W, Qiu R, et al.
Materials (Basel) . 2022 Nov; 15(21). PMID: 36363044
At present, many experimental fast reactors have adopted alloy nuclear fuels, for example, U-Zr alloy fuels. During the neutron irradiation process, vacancies and hydrogen (H) impurity atoms can both exist...
7.
Ma J, Liu Q, Liu P, Zhang P, Sanyal B, Ouyang T, et al.
Phys Chem Chem Phys . 2022 Aug; 24(35):21261-21269. PMID: 36040434
In layered materials with the stacking axis perpendicular to the basal plane, anharmonicity strongly affects phonon propagation due to weak interlayer coupling, which is helpful to reduce the lattice thermal...
8.
Li X, Si J, Shi L, Liu P, Zhang P, Wang B
Phys Chem Chem Phys . 2022 Jul; 24(30):18419-18426. PMID: 35880864
Materials with superconductivity and a nontrivial band structure near the Fermi level are promising candidates in realizing topological superconductivity. Using first-principles calculations, we systematically investigated the stability, mechanical properties, superconductivity,...
9.
Mu Y, Wang B, Li S, Ding F
Nanoscale . 2022 Jun; 14(27):9754-9761. PMID: 35766045
Monolayer borophenes tend to be easily oxidized, while thicker borophenes have stronger antioxidation properties. Herein, we proposed four novel metallic boron crystals by stacking the experimentally synthesized borophenes, and one...
10.
Yan L, Zhu J, Wang B, He J, Song H, Chu W, et al.
Nano Lett . 2022 Jun; 22(13):5592-5599. PMID: 35729076
The number of semiconducting MXenes with direct band gaps is extremely low; thus, it is highly desirable to broaden the MXene family beyond carbides and nitrides to expand the palette...