Lecture 26 Molecular orbital theory II. Numerical aspects of MO theory We learn and carry out a mathematical procedure to determine the MO coefficients,
Lecture 26 Molecular orbital theory II (c) So Hirata, Department of Chemistry, University of Illinois at Urbana-Champaign. This material has been developed.
III Solution of pde’s using variational principles Introduction Euler-Lagrange equations Method of Ritz for minimising functionals Weighted residual methods.
III Solution of pde’s using variational principles
