Concepedia

An electronic structure study of acetone by electron momentum spectroscopy: a comparison with SCF, MRSD-CI and density functional theory

Yajing Zheng, John J. Neville, C.E. Brion, Y. Wang, Ernest R. Davidson

Chemical Physics · 1994 · 52 citations · 32 references

DOI

Concepts

References

32

Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules

R. Ditchfield, Warren J. Hehre, John A. Pople · The Journal of Chemical Physics · 1971 · 10.5K citations

, , +15

Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic Orbitals

Warren J. Hehre, R. F. Stewart, John A. Pople · The Journal of Chemical Physics · 1969 · 4.2K citations

, , +17

Contribution of triple substitutions to the electron correlation energy in fourth order perturbation theory

R. Krishnan, Michael J. Frisch, John A. Pople · The Journal of Chemical Physics · 1980 · 1.2K citations

, , +13

Microchannel plate detectors

Joseph Ladislas Wiza · Nuclear Instruments and Methods · 1979 · 1.2K citations

General contraction of Gaussian basis sets. I. Atomic natural orbitals for first- and second-row atoms

Jan Almløf, Peter R. Taylor · The Journal of Chemical Physics · 1987 · 1.1K citations

, , +16