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Valuation methods within LCA - Where are the values?

✍ Scribed by Göran Finnveden

Book ID
105673410
Publisher
Springer-Verlag
Year
1997
Tongue
English
Weight
705 KB
Volume
2
Category
Article
ISSN
0948-3349

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The valuation step within LCA
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## Abstract Within the presented LCAS MS (linear combination of atomic spinors–molecular spinors) SCF formalism both large and small components of the spinor radial parts have been expanded within the Gaussian basis set. The respective expressions for matrix elements as well as for one‐ and two‐ele