Concepedia

Influence of (S)-1-phenylethylamine para substitution on the resolution of (±)-1,4-benzodioxane-2-carboxylic acid: a crystallographic, theoretical and morphologic approach

N. Marchini, G. Bombieri, Roberto Artali, Cristiano Bolchi, Marco Pallavicini, Ermanno Valoti

Tetrahedron Asymmetry · 2005 · 15 citations · 6 references

DOI

Concepts

References

6

Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields

Philip J. Stephens, F. J. Devlin, Cary F. Chabalowski et al. · The Journal of Physical Chemistry · 1994 · 23.1K citations

, , +16

A new mixing of Hartree–Fock and local density-functional theories

Axel D. Becke · The Journal of Chemical Physics · 1993 · 16.4K citations

, , +11

Self-consistent molecular orbital methods 25. Supplementary functions for Gaussian basis sets

Michael J. Frisch, John A. Pople, J. Stephen Binkley · The Journal of Chemical Physics · 1984 · 8.5K citations

, , +14

<i>SIRPOW</i>.92 – a program for automatic solution of crystal structures by direct methods optimized for powder data

Angela Altomare, G. Cascarano, Carmelo Giacovazzo et al. · Journal of Applied Crystallography · 1994 · 6.9K citations

, , +17

Aqueous Solubility: Methods of Estimation for Organic Compounds

D. Mackay · Journal of Environmental Quality · 1993 · 182 citations

, , +11