In the last post we computed Hückel calculations for two p orbitals in conjugation. Let us now try to figure out how to calculate energies for
Tag: Calculations of HMO theory
115.Calculations of HMO theory(2).
In the previous post we arrived at two simultaneous equations (We are using two different colors in order to distinguish between the two equations)- ciα
114.Calculations of HMO theory(1).
In this post let us apply the LCAO method and approximations we studied earlier to a simple conjugated molecule and carry out the calculations for
Madoverchemistry 