University of Liege | Version française
Study programmes 2007-2008Last update : 7/05/2008
CHIM0212-1  Physical chemistry II, molecular aspects
Duration :  30h Th, 15h Pr, 15h QA Sess.
Credits/ECTS :  
"licencié" chemical sciences, 1st year8
Holder(s) :  
Language :  Langue française
Course contents :  0. Introduction and motivation
I. Introduction to molecular electronic structure : simple systems
II. Symmetry of molecular orbitals
III. The Hückel method
IV. Selection rules in optical spectroscopy
V. Hartree-Fock Theory applied to molecules
VI. Beyond Hartree-Fock Theory
VII. Applications to reactivity at the molecular level
Course objective :  Theoretical concepts and computing methods that allow an understanding of the structural and electronic molecular properties and of the chemical reactivity at the molecular level
Prerequisites :  Fundamentals of quantum mechanics
Organization :  Course : 30 h , first semester
Exercises : 15h at the first semester
Lab : 15h on computer at the first semester
Written notes :  available at the first semester
Assessment :  oral and written exams, general interrogation on exercises
Contacts :  Francoise Remacle.
Bureau R81, Bâtiment B6c Licence-Recherche
Email : fremacle@ulg.ac.be
Tél. 04 3662347


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