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Atoms-in-molecules in momentum space: A Hirshfeld partitioning of electron momentum densities

โœ Scribed by Balanarayan, P.; Gadre, Shridhar R.


Book ID
126197586
Publisher
American Institute of Physics
Year
2006
Tongue
English
Weight
622 KB
Volume
124
Category
Article
ISSN
0021-9606

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rn Motivated by McWeeny's pioneering work on the solution of the Schrodinger equation in momentum space and his early treatment of X-ray scattering factors from the electron distribution p(r) in both isolated and bonded atoms, the relation between momentum space moments ( p") and p(r) is first devel