A5100414320- Inorganic Chemistry and Materials
- Crystallization and Solubility Studies
- X-ray Diffraction in Crystallography
- Advanced Chemical Physics Studies
- Boron and Carbon Nanomaterials Research
- Inorganic Fluorides and Related Compounds
- MXene and MAX Phase Materials
- Radioactive element chemistry and processing
- Molecular Junctions and Nanostructures
- Crystallography and molecular interactions
- Nonlinear Optical Materials Research
- Ammonia Synthesis and Nitrogen Reduction
- Advanced Photocatalysis Techniques
- Synthesis and characterization of novel inorganic/organometallic compounds
- Graphene research and applications
- Nanocluster Synthesis and Applications
- Synthesis and Properties of Aromatic Compounds
- Advanced biosensing and bioanalysis techniques
- Catalytic Processes in Materials Science
- Crystal Structures and Properties
- Quantum and electron transport phenomena
- High-pressure geophysics and materials
- Covalent Organic Framework Applications
- Chemical Synthesis and Characterization
- Hydrogen Storage and Materials
Jilin Medical University
2013-2025
Jilin University
2016-2025
Beijing Institute of Technology
2021-2024
Longhua Hospital Shanghai University of Traditional Chinese Medicine
2024
Shanghai University of Traditional Chinese Medicine
2024
Xuzhou Medical College
2023
Fujian Medical University
2016-2023
Army Medical University
2023
University of Science and Technology of China
2023
Zhejiang University
2023
An alkali-metal-doped effect on the nonlinear optical (NLO) property in new electrides is studied. The are formed by doping alkali atom Li into a fluorocarbon chain H−(CF2−CH2)3−H. Six stable structures of Lin−H−(CF2−CH2)3−H (n = 1, 2) complexes with all real frequencies obtained at MP2/6-31+G (d) level. Among these six structures, largest first static hyperpolarizabilities (β0) found to be 76 978 au, which much larger than β0 value 112 au for Clearly, Li-atom-doped hyperpolarizability...
A new type of superalkali-(super)halogen compound, BLi6-X (X = F, LiF2, BeF3, BF4), is theoretically predicted. The interaction between superalkali BLi6 and different shaped superhalogen X found to be strong ionic in nature. Bond energies these species are the range 151.3−220.6 kcal/mol at CCSD(T)/aug-cc-pVDZ level, which much larger than traditional bond energy 130.1 for LiF. Furthermore, because their delocalized electron character, exhibit extraordinarily large first hyperpolarizabilities...
A new series of superalkali-based alkalides, i.e., Li3(+)(calix[4]pyrrole)M(-), Li3O(+)(calix[4]pyrrole)M(-), and M3O(+)(calix[4]pyrrole)K(-) (M = Li, Na, K), have been theoretically designed investigated by means density functional theory computations. These species diverse structural isomers, in which the embedded superalkali units maintain their identities prefer horizontal orientation over vertical one. All proposed alkalides exhibit considerable first hyperpolarizabilities (β0) up to...
A series of stable inorganic electrides with a large nonlinear optical response and deep-ultraviolet transparency were theoretically designed investigated.
Abstract Decorating single atoms of transition metals on MXenes to enhance the electrocatalytic properties resulting composites is a useful strategy for developing efficient electrocatalysts, and mechanisms behind this enhancement are under intense scrutiny. Herein, we anchored Co onto several commonly used MXene substrates (V 2 CT x , Nb Ti 3 C T ) systematically studied behavior oxygen hydrogen evolution reactions (OER HER, respectively) composites. Co@V composite displays an OER...
Melamine is an emerging contaminant in milk, infant formula and pet food.
Gastric cancer is one of the most prevalent and aggressive cancers worldwide, its molecular mechanism remains largely elusive. Here we report genomic landscape in primary gastric adenocarcinoma human, based on complete genome sequences five pairs matching normal samples. In total, 103,464 somatic point mutations, including 407 nonsynonymous ones, were identified recurrent mutations harbored by Mucins (MUC3A MUC12) transcription factors (ZNF717, ZNF595 TP53). 679 rearrangements detected,...
A new type of binuclear superalkali B(2)Li(11) and its corresponding cation (+) were theoretically predicted based on the density functional theory calculations. was found to have six minimum energy structures five states exhibiting nature. The global minima are similar each other in structure, where two central boron atoms directly link whole geometry resembles a capsule with an additional Li atom localized side. vertical electron affinities for cations at OVGF/6-311+G(3df) level range...