Semi-empirical quantum chemistry method

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Covers eigenvalues, eigenfunctions, Hermitian operators, and the measurement of observables in quantum chemistry.

Covers perturbation theory in quantum chemistry, variational principle, Pauli principle, and separability of operators.

Covers quantum states, shapes, Coulomb integrals, and energy calculations in Chemistry.

Explores theoretical calculations of magnetic interactions in an insulating system with two inequivalent Co sites using quantum chemistry methods.

Covers the fundamentals of quantum chemistry, including Coulomb and exchange integrals, atomic and molecular orbitals.

Explores potential energy surfaces in molecular dynamics simulations and the use of mixed quantum mechanical/molecular mechanical methods.

Explores quantum chemical electronic structure methods, including basis sets and the Hartree-Fock method.

Explores the Hartree-Fock method, basis sets, Slater determinants, and quantum chemistry concepts like spin contamination and Hund's rule.

Covers the basics of quantum chemistry and the Hartree-Fock method.

Delves into Moller-Plesset Perturbation Theory, discussing energy corrections and wavefunction expansion in quantum chemistry.