Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Short-Range Interactions and Orbital Expansions

In the standard models of quantum chemistry of Chapter 5, the A -electron wave function is expanded in products of the one-electron basis functions introduced in Chapter 6. In the present chapter, we shall examine the orbital expansion of the many-electron systems by considering a simple two-electron system the ground-state helium wave function. In this manner, we shall obtain a clearer picture of the possibilities and limitations offered by the orbital expansion for many-electron systems. The information obtained by studying the helium system will later prove useful when we go on to construct molecular basis sets from AOs in Chapter 8. [Pg.256]


See other pages where Short-Range Interactions and Orbital Expansions is mentioned: [Pg.256]    [Pg.257]    [Pg.259]    [Pg.261]    [Pg.265]    [Pg.267]    [Pg.269]    [Pg.271]    [Pg.273]    [Pg.275]    [Pg.279]    [Pg.283]    [Pg.285]    [Pg.256]    [Pg.257]    [Pg.259]    [Pg.261]    [Pg.265]    [Pg.267]    [Pg.269]    [Pg.271]    [Pg.273]    [Pg.275]    [Pg.279]    [Pg.283]    [Pg.285]    [Pg.659]    [Pg.545]    [Pg.155]    [Pg.148]    [Pg.100]    [Pg.374]    [Pg.20]    [Pg.93]    [Pg.337]    [Pg.23]    [Pg.102]   


SEARCH



Orbital expansion

Orbitals expansions

Short-range

© 2024 chempedia.info