Covers basis set errors, Hartree-Fock methods, electron correlation, configuration interaction, and composite approaches in computational chemistry.
Covers the derivation of Hartree-Fock equations, two-electron integrals, dynamical and static correlation, continuous basis functions, spin contamination, and the coupled cluster method.
Explores Basis Set Superposition Error in quantum chemistry calculations and the Counter-Poise correction to estimate it.
Covers Quantum Chemistry topics like SP Hybridization and orbital conservation.
Explores electron density in chemistry, from atomic models to machine learning applications and implications for molecular properties and drug design.
