综合实验和第一原理研究 (Ce,Mo) 杂的BiVO4
Tasnim Ahmed Mahi1, Quazi Shafayat Hossain1, Sadiq Shahriyar Nishat2
1Materials Science Research Laboratory, Department of Electrical and Electronic Engineering, University of Dhaka, Dhaka-1000, Bangladesh.
Heliyon
|December 13, 2024
概括
这项研究探讨了 (Ce) 和 (Mo) 在慕瓦纳酸盐 (BiVO) 纳米颗粒中的兴奋剂. 联合兴奋剂增强了光生成载体重组,可能阻碍甲基蓝降解的光催化效率.
科学领域:
- 材料科学 材料科学 材料科学
- 纳米技术 纳米技术
- 光催化作用的光催化
背景情况:
- 乙瓦纳酸盐 (BiVO) 是一个有前途的光催化剂.
- 使用兴奋剂策略来提高光催化性能.
- 了解对BiVO4的兴奋剂影响对于优化其应用至关重要.
研究的目的:
- 研究 (Ce) 和 (Mo) 联合兴奋剂对水热合成的BiVO纳米粒子的影响.
- 证实辅助兴奋剂诱导的结构和化学变化.
- 分析兴奋剂对光生成载体动力学和光催化活性的影响.
主要方法:
- BiVO4纳米颗粒的水热合成.
- 粉末式X射线衍射 (PXRD) 使用瑞特维尔德精细化.
- 拉曼光谱和里埃变换红外光谱 (FTIR).
- 高分辨率传输电子显微镜 (HRTEM) 和X射线光电子谱学 (XPS).
- 光发光 (PL) 光谱和UV-VIS分散反射光谱.
- 密度函数理论 (DFT+U) 的模拟.
主要成果:
- 验证了BiVO4纳米颗粒中单临石和四角基相的存在.
- 分别在Bi和V地点确认了Ce和Mo的辅助兴奋剂.
- 观察到 (Ce, Mo) 协同使用的BiVO4中增强的光生成载体重组.
- DFT+U模拟显示了深层杂质状态,有助于载体重组.
- 紫外线对散射反射率支持存在缺陷状态.
结论:
- 与Ce和Mo联合使用BiVO4引入了深度杂质状态.
- 这些杂质状态增强了光生成载体重组.
- 增加的重组可能会阻碍甲蓝降解的光催化效率.
- 这项研究提供了一个全面的实验和计算分析 (Ce,Mo) 化BiVO.
相关概念视频
Molecular and Ionic Solids
16.9K
Crystalline solids are divided into four types: molecular, ionic, metallic, and covalent network based on the type of constituent units and their interparticle interactions.
Molecular Solids
Molecular crystalline solids, such as ice, sucrose (table sugar), and iodine, are solids that are composed of neutral molecules as their constituent units. These molecules are held together by weak intermolecular forces such as London dispersion forces, dipole-dipole interactions, or hydrogen bonds, which...
Molecular Solids
Molecular crystalline solids, such as ice, sucrose (table sugar), and iodine, are solids that are composed of neutral molecules as their constituent units. These molecules are held together by weak intermolecular forces such as London dispersion forces, dipole-dipole interactions, or hydrogen bonds, which...
16.9K
MO Theory and Covalent Bonding
10.3K
The molecular orbital theory describes the distribution of electrons in molecules in a manner similar to the distribution of electrons in atomic orbitals. The region of space in which a valence electron in a molecule is likely to be found is called a molecular orbital. Mathematically, the linear combination of atomic orbitals (LCAO) generates molecular orbitals. Combinations of in-phase atomic orbital wave functions result in regions with a high probability of electron density, while...
10.3K
Ferromagnetism
2.4K
Materials like iron, nickel, and cobalt consist of magnetic domains, within which the magnetic dipoles are arranged parallel to each other. The magnetic dipoles are rigidly aligned in the same direction within a domain by quantum mechanical coupling among the atoms. This coupling is so strong that even thermal agitation at room temperature cannot break it. The result is that each domain has a net dipole moment. However, some materials have weaker coupling, and are ferromagnetic at lower...
2.4K
Theory of Metallic Conduction
1.3K
The conduction of free electrons inside a conductor is best described by quantum mechanics. However, a classical model makes predictions close to the results of quantum mechanics. It is called the theory of metallic conduction.
In this theory, Newton's second law of motion is used to determine the acceleration of an electron in the presence of an applied electric field. Then, its velocity is expressed via this acceleration.
An electron moves through the crystal, containing positive ions,...
In this theory, Newton's second law of motion is used to determine the acceleration of an electron in the presence of an applied electric field. Then, its velocity is expressed via this acceleration.
An electron moves through the crystal, containing positive ions,...
1.3K
Biasing of Metal-Semiconductor Junctions
215
Biasing metal-semiconductor junctions involves applying a voltage across the junction. Specifically, the metal is connected to a voltage source, while the semiconductor is grounded. This technique is essential for controlling the direction and magnitude of current flow in electronic devices, including diodes, transistors, and photovoltaic cells.
In Schottky junctions, where the semiconductor is n-type, applying a positive voltage to the metal relative to the semiconductor reduces its Fermi...
In Schottky junctions, where the semiconductor is n-type, applying a positive voltage to the metal relative to the semiconductor reduces its Fermi...
215
Induced Electric Dipoles
4.2K
A permanent electric dipole orients itself along an external electric field. This rotation can be quantified by defining the potential energy because the external torque does work in rotating it. Then, the potential energy is minimum at the parallel configuration and maximum at the antiparallel configuration. While the former is a stable equilibrium, the latter is an unstable equilibrium.
Since the absolute value of potential energy holds no physical meaning, its zero value can be chosen as per...
Since the absolute value of potential energy holds no physical meaning, its zero value can be chosen as per...
4.2K


