A5065000356- Boron and Carbon Nanomaterials Research
- Fullerene Chemistry and Applications
- Graphene research and applications
- Boron Compounds in Chemistry
- Advanced Sensor and Energy Harvesting Materials
- Advanced Chemical Physics Studies
- Tactile and Sensory Interactions
- Advancements in Battery Materials
- Diamond and Carbon-based Materials Research
- Quantum Dots Synthesis And Properties
- Quantum and electron transport phenomena
- Muscle activation and electromyography studies
Jilin Normal University
2021-2025
Direct protein analysis from complex cellular samples is crucial for understanding diversity and disease mechanisms. Here, we explored the potential of SiNx solid-state nanopores single-molecule from...
The luminescent spectra of boron–nitrogen (BN) superatoms under the influence small molecule excitation remain unexplored, yet hold promising prospects for application in materials. This study employs density functional theory to investigate absorption and fluorescence emission molecules (pyrazine, pyridine, benzene) adsorbed on B12N12 superatoms. findings reveal formation stable chemisorption structures, namely pyrazine-B12N12 pyridine-B12N12, while benzene forms a physisorption structure...
The luminescence characteristics of small molecule excited B 40 is studied. results show that the adsorbed pyridine and pyrazine can enhance emission spectrum , while benzene has almost no effect on spectra .
Superatoms are crucial in the assembly of functional and optoelectronic materials. This study investigates endohedral metallo-boron nitride [boron (BN)] fullerenes U@B12N12, Cm@B12N12, U@B16N16 theory. Our findings confirm that superatoms their electronic configurations 1P61S21D101F142P62S22D102F123P6, 1P61S21D101F141G161H162S22P62D102F12, 1P61S21D101F142P62S22D102F14, respectively. Notably, orbital energy levels these exhibit a flipping phenomenon, deviating from those previous superatom...
Abstract The spin polarization of carbon nanomaterials is crucial to design spintronic devices. In this paper, the first‐principles used study electronic properties two defect asymmetric structures, Cap‐(9, 0)‐Def [6, 6] and [5, 6]. We found that ground state sextet quartet, former has a lower energy. addition, compared with 0) CNTs, C adatom on 30 causes phenomenon more electrons than structure. Moreover, different adsorb defects reveal electron accumulation. This finding shows structure...
Superatom-assembled materials have highly tunable magnetic and electronic properties parameters of clusters. Here, eight superatom dimers composed two U@B40 motifs been studied by the density functional theory. Calculation results show that exhibit spin antiferromagnetic coupling, ferromagnetic coupling nonmagnetic, is, is induced interaction between superatoms. In addition, monomers in still retain superatomic orbitals, some super atomic orbitals disappear due to monomers. The assembly...
The spin polarization of carbon nanomaterials is crucial to design spintronic devices. In this paper, the first-principles used study electronic properties two defect asymmetric structures, Cap-(9, 0)-Def [6, 6] and [5, 6]. We found that ground state sextet quartet, former has a lower energy. addition, compared with 0) CNTs, C adatoms on C30 causes phenomenon Cap- (9, more electrons than structure. Moreover, different adsorb defects reveal electron accumulation. This finding shows structure...