Concepedia

Theoretical and experimental vibrational spectrum study of 4-hydroxybenzoic acid as monomer and dimer

Silvia Antonia Brandán, Fernando Márquez López, Manuel Montejo, Juan Jesús López González, A. Ben Altabef

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2010 · 64 citations · 43 references

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43

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

Thom H. Dunning · The Journal of Chemical Physics · 1989 · 31.7K citations

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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

Free radicals in biology and medicine

General Pharmacology The Vascular System · 1991 · 17.2K citations

, , +12

Structure-antioxidant activity relationships of flavonoids and phenolic acids

Catherine Rice‐Evans, Nicholas J. Miller, George Paganga · Free Radical Biology and Medicine · 1996 · 8.9K citations

, , +14

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