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1. Theoretical Study Of Intramolecular Nucleophilic Substitution On Nitrogen And Tautomerism Of 2-Aminothiazole
2. Natural Bond Orbital Analysis Of Nucleus-Independent Chemical Shifts Of Aromaticity And Antiarmaticity
3. The Electronic Properties Of Conjugated Polymers And Their Monomers And Oligomers
4. Theoretical Study On The Aromaticity Of Planar Heterocyclic Aromatic Compounds
5. The Theoretic Study Of The Structure And Aromaticity Of Purines
6. Theoretic Study On Aromaticity Of 3n(n=1, 2) Membered Rings
7. Theoretical Study On The Structuries, Bonding Energies And Aromaticities For The Sandwich Complexes Containing E42- (N, P, As, Sb And Bi) Ligands
8. Molecular Design And DFT Investigation Of Organic Conductor Based Upon The Pyrazine Group
9. Theoretical Study On The Aromaticity Of Heterobenzenes And Intramolecular Proton Transfer Of2-(6’-hydroxy-heterophenyl) Benzomidazoles
10. Structural And Bonding Analyses Of Double-Chain Ribbon, Triple-Ring Tube, And Cage-Like Boron Clusters
11. Theoretical Studies On The Structures And Properties Of (4,6)-Fullerenes
12. Investigations On Geometrical Structures And Stabilities Of Boron-rich Hydroboron Clusters
13. Claisen Rearrangement And Similar Reaction And Aromatic Transition State Theory Research
14. A Computational Study On The Mechanism Of Intermolecular C-H Amination With Electrophilic Nitrogen Source Catalyzed By Palladium And Nucleus-Independent Chemical Shift Analysis Of The Electronic States Of The（CX）4（X=O,S,Se） Molecules
15. Theoretical Study On Structure And Properties Of Germanium Cluster Ge_n And Transition Metal Cu Doped Germanium Clusters CuGe_n
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