Practical Course: Computational Methods for Electronic Structure
This course is a supplement to the lecture “Computational methods for electronic structure” and gives the possibility to use the discussed methods in practice. Different molecular properties will be calculated by several program packages therefore the students will acquire advanced skills in application of electronic structure methods.
Lecture notes Suggested: Attila Szabo, Neil S. Oslund: Modern Quantum Chemistry, Dover Publications, 1996 Press, 2005
Electronic Structure: Basic Theory and Practical Methods (v. 1) 1st Edition by Richard M. Martin, Cambridge University Press (2008)