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Keyword [Firstprinciples]
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1. First-prinicples Study Of Doped Cubic Boron Nitride
2. The Structures And Propetries Of Several Typical Hydrides Under High Pressures
3. First-principles Study On The Adsorption Of Hydrated Rare Earth Ions On The Surface Of Kaolinite
4. First-principles Study On The Electronic Structure Modulation Of Novel Twodimensional Materials And Their Heterojunctions
5. Study On Defect Energetics And Thermal Properties Of Ln3TaO7(Ln=La-Ho) Weberites By Firstprinciples Calculations
6. A First-principles Study Of Charge Transfer Mechanism Of Atomic-scale Friction
7. Study Of The Effect Of Defects And Their Diffusion Dynamics On The Properties And Stability Of New-Type Semiconductors
8. The Influence Of Self-trapped Excitons On The Photoelectric Properties Of Semiconductors: First-principles Studies
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