Introduction to Molecular Mechanics - Mahidol University
Introduction to Molecular Mechanics - Mahidol University
Introduction to Molecular Mechanics - Mahidol University
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Electronic Structure<br />
Electronic Structure methods: ab initio, DFT, Tight-Binding, semi-empirical QM<br />
Properties of matters/materials can be determined by knowing how<br />
electrons stay in the nanostructures.<br />
• Electronic structure<br />
• Chemical force<br />
• Geometry of molecule,<br />
nanostructure<br />
• Electronic properties<br />
• Thermodynamic<br />
properties<br />
• Mechanical properties<br />
Electronic Structure<br />
Materials Properties