Evaluate results of electronic structure calculations

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Reference no: EM133101870

CH4313 Quantum and Statistical Mechanics of Molecules and Solids for Distance Learners

Question 1: Demonstrate awareness of methods for description of electronic structure of molecules and solids.

Question 2: Describe means to relate molecular to macroscopic properties using the techniques of statistical mechanics.

Question 3: Evaluate results of electronic structure calculations, critically assess their performance and extract chemically relevant properties.

Question 4: Calculate thermodynamic and kinetic properties of molecular systems from knowledge of molecular properties.

Question 5: Understand and predict key properties of materials based on a band structure description of their electronic structure.

Question 6: Retrieve and communicate data, findings and procedures from a variety of sources (literature, electronic databases, experiments/calculations).

Reference no: EM133101870

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