Concepedia

Preoptimised VB: a fast method for the ground and excited states of ionic clusters I. Localised preoptimisation for (ArCO)+, (ArN2)+ and N4+

J. H. Langenberg, I.B. Bucur, Pierre Archirel

Chemical Physics · 1997 · 19 citations · 27 references

DOI

Concepts

References

27

The spectrum of molecular nitrogen

A Lofthus, Paul H. Krupenie · Journal of Physical and Chemical Reference Data · 1977 · 1.6K citations

, , +17

A theoretical method to determine atomic pseudopotentials for electronic structure calculations of molecules and solids

Philippe Durand, Jean‐Claude Barthelat · Theoretical Chemistry Accounts · 1975 · 896 citations

, , +16

Gaussian basis set for molecular wavefunctions containing second-row atoms

A. Veillard · Theoretical Chemistry Accounts · 1968 · 484 citations

, , +16

Ground and excited states of Ne2 and Ne2+. I. Potential curves with and without spin-orbit coupling

James S. Cohen, Barry I. Schneider · The Journal of Chemical Physics · 1974 · 420 citations

, , +17

Self-Consistent Procedures for Generalized Valence Bond Wavefunctions. Applications H3, BH, H2O, C2H6, and O2

William J. Hunt, Phillipa Hay, William A. Goddard · The Journal of Chemical Physics · 1972 · 388 citations

, , +17