Concepedia

Vibrational spectra of halophthalonitriles

Mathew D. Halls, Ricardo F. Aroca, Dmitri S. Terekhov, Anna M. D’Ascanio, Clifford C. Leznoff

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 1998 · 15 citations · 20 references

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20

Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis

S. H. Vosko, L. Wilk, Marwan Nusair · Canadian Journal of Physics · 1980 · 20.7K citations · Full text

, , +15

Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular model

Michael J. S. Dewar, Eve G. Zoebisch, Eamonn F. Healy et al. · Journal of the American Chemical Society · 1985 · 13.1K citations

, , +10

Optimization of parameters for semiempirical methods I. Method

James J. P. Stewart · Journal of Computational Chemistry · 1989 · 7.6K citations

, , +4

Vibrational frequency prediction using density functional theory

Ming Wah Wong · Chemical Physics Letters · 1996 · 1.2K citations

, , +14

<i>Quantum Theory of Molecules and Solids Vol. 4: The Self-Consistent Field for Molecules and Solids</i>

J. C. Slater, J. C. Phillips · Physics Today · 1974 · 625 citations

, , +16