Concepedia

Fourier transform infrared study of perchlorate ( 35 ClO 4 − and 37 ClO 4 − ) anions isomorphously isolated in potassium permanganate matrix. Vibrational anharmonicity and pseudo-symmetry effects

Ljupčo Pejov, Vladimir M. Petruševski

Journal of Physics and Chemistry of Solids · 2002 · 30 citations · 27 references

DOI

Concepts

References

27

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 101.1K citations

, , +13

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 98.6K citations

, , +14

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 61.8K citations · Full text

, , +16

Optimization of equilibrium geometries and transition structures

H. Bernhard Schlegel · Journal of Computational Chemistry · 1982 · 3.8K citations

, , +12

Infrared and Raman spectra of crystals

W.J. O.-T · Journal of Molecular Structure · 1973 · 280 citations

, , +8