README.md

Exercises

• Exercise 1: Compute the electronic strcture of the O₃ molecule at the KI level using the koopmans package and the kcp.x code
• Exercise 2: Use the koopmans package and the kcp.x code to compute the KI band structure of FCC Si
• Exercise 3: Use kcw.x to compute the KI electronic structure of the O₃ molecule
• Exercise 4: Use kcw.x to compute the KI electronic structure of bulk Silicon.
• Exercise 5: Use kcw.x to compute the KI electronic structure of ZnO

Inside each folder you'll find the inputs file to run the calculations and a "reference" folder with reference output files.