Concepedia

The torsional dependence of an interaction potential: the CH3OHHe system

Stephen L. Davis, William R. Entley

Chemical Physics · 1992 · 11 citations · 18 references

DOI

Concepts

References

18

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

Samuel Francis Boys, Fernando Bernardi · Molecular Physics · 1970 · 22K citations

, , +10

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

Gaussian-Type Functions for Polyatomic Systems. II

Sigeru Huzinaga, Yoshiko Sakai · The Journal of Chemical Physics · 1969 · 3.2K citations

, , +15

An improved simple model for the van der Waals potential based on universal damping functions for the dispersion coefficients

K. T. Tang, J. P. Toennies · The Journal of Chemical Physics · 1984 · 1.6K citations

, , +15