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Orbital and excitonic descriptions of molecular excited and ionized states

โœ Scribed by Armelle Denis; Jacqueline Langlet; J. P. Malrieu


Publisher
Springer
Year
1973
Tongue
English
Weight
772 KB
Volume
29
Category
Article
ISSN
1432-2234

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Modern valence bond descriptions of mole
โœ Thorstein Thorsteinsson; David L. Cooper ๐Ÿ“‚ Article ๐Ÿ“… 1998 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 466 KB ๐Ÿ‘ 2 views

The valence bond description of excited states is considered in the context of the CASVB approach, with emphasis on the simultaneous optimization of orbitals and structure coefficients for highly general types of wave function, as well as ลฝ . the close connection to the complete active space self-co