Concepedia

Theoretical treatment of multiple site reactivity in large molecules

Rodney J. Bartlett, Harel Weinstein

Chemical Physics Letters · 1975 · 45 citations · 17 references

DOI

Concepts

References

17

Molecular orbital theory of the electronic structure of organic compounds. I. Substituent effects and dipole moments

John A. Pople, Mark S. Gordon · Journal of the American Chemical Society · 1967 · 1K citations

, , +11

Atomic polarizabilities and shielding factors

A. Dalgarno · Advances In Physics · 1962 · 869 citations

, , +16

Perturbed Hartree—Fock Calculations. I. Magnetic Susceptibility and Shielding in the LiH Molecule

Richard M. Stevens, Russell M. Pitzer, William N. Lipscomb · The Journal of Chemical Physics · 1963 · 506 citations

, , +17

Molecular SCF Calculations for the Ground State of Some Three-Membered Ring Molecules: (CH2)3, (CH2)2NH, (CH2)2NH2+, (CH2)2O, (CH2)2S, (CH)2CH2, and N2CH2

Rosanna Bonaccorsi, Eolo Scrocco, Jacopo Tomasi · The Journal of Chemical Physics · 1970 · 394 citations

, , +17

Approximations to Hartree—Fock Perturbation Theory

P. W. Langhoff, Martin Karplus, R. P. Hurst · The Journal of Chemical Physics · 1966 · 361 citations

, , +13