Optimum atomic orbitals for molecular calculations. A review

  title={Optimum atomic orbitals for molecular calculations. A review},
  author={Frank R. Burden and R. Marshall Wilson},
Abstract This review is intended to give a broad outline of the many techniques used in the calculation of atomic structure and the methods of using the information gained from this work in molecular calculations. Consequently, no topic is considered in full depth and only selected examples from the literature are used to illustrate the main points. Extensive tabulatios of atomic and molecular properties are already available in the literature, and these serve as additional sources of examples… CONTINUE READING