Concepedia

Nuclear relaxation and vibrational contributions to the static electrical properties of polyatomic molecules: beyond the Hartree-Fock approximation

Josep M. Luis, Josep Samitier Martí, Miquel Duran, JoséL. Andrés

Chemical Physics · 1997 · 31 citations · 91 references

DOI

Concepts

References

91

Note on an Approximation Treatment for Many-Electron Systems

CHR. KN. MØLLER, M. S. Plesset · Physical Review · 1934 · 14.6K citations

, , +11

Gaussian Basis Functions for Use in Molecular Calculations. I. Contraction of (9s5p) Atomic Basis Sets for the First-Row Atoms

Thom H. Dunning · The Journal of Chemical Physics · 1970 · 5K citations

, , +15

Gaussian-Type Functions for Polyatomic Systems. I

Sigeru Huzinaga · The Journal of Chemical Physics · 1965 · 5K citations

, , +12

Quadratic configuration interaction. A general technique for determining electron correlation energies

John A. Pople, Martin Head‐Gordon, Krishnan Raghavachari · The Journal of Chemical Physics · 1987 · 4.5K citations

, , +17

Optimization of equilibrium geometries and transition structures

H. Bernhard Schlegel · Journal of Computational Chemistry · 1982 · 3.9K citations

, , +14