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Modeling electron density distributions from X-ray diffraction to derive optical properties: Constrained wavefunction versus multipole refinement

Author:
Hickstein, Daniel D.
Journal:
The Journal of chemical physics
ISSN:
0021-9606
Date:
08/2013
 
Volume: 139   Issue: 6   Page: 064108
PMID:
23947844
DOI:
10.1063/1.4817662

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