Evaluate results of electronic structure calculations

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

Questions Cloud

Difference between laws and ethics? : What is the difference between laws and ethics? How does each fit in the intelligence world?

Compute the Working capital financial data and ratios : The dividend per share of common stock was $0.75 last year and $0.40 this year. Compute the Working capital financial data and ratios

Prepare an income statement for the month of May : The mortgage interest rate is 5%. (The mortgage was taken out on May 1.) Prepare an income statement for the month of May

Describe the nature of orbital interactions : Predict the physical properties resultant from the orbital overlap in varying complexes and Recognise bonding/structure relationships in transition metal

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

Synthesis and analysis of biological macromolecules : Evaluate experimental data and relate this to the underlying biological processes and Design experimental strategies to synthesise

Calculate the FCFs for this project : The average annual sales per sqm of a traditional convenience store is $15,000. Calculate the FCFs for this project? What is the IRR

Potential applications of metal complexes : Describe the nature of orbital interactions in metal-ligand and metal-metal examples and Demonstrate an awareness of the potential applications of metal complex

What is the total amount to be budgeted : Coronado has 4700 pounds of clay mix in beginning inventory and wants to have 3900 pounds in ending inventory. What is the total amount to be budgeted

User Account

All Pages