Ab initio theoretical calculation of experimental structure factors for (ND4)2Cu(SO4)2·6D2O at 9 K

Chemical Physics Letters

Volumn 225, Issue 4-6, 1994, Pages 421-426

  Chandler, G S ^a   Figgis, B N ^a   Reynolds, P A ^a   Wolff, S K ^a  

^a UNIVERSITY OF WESTERN AUSTRALIA   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001239839     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(94)87105-1     Document Type: Article

References (28)

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3. The influence of intermolecular interactions on the electron-density distribution. A comparison of experimental and theoretical results for α-oxalic acid dihydrate
4. Fourier transforms of Gaussian orbital products
5. Neutron diffraction at 115 K to 1.09 Å–1 from cobalt phthalocyanine
6. X–Nstudy of the electron density in (ND4)2Cu(SO4)2.6D2O at 9 K: flexible radial functions are vital
7. Charge density around a Jahn-Teller-distorted site: (ND4)2Cu(SO4)2.6D2O at 85 K
8. Testing aspherical atom refinements on small-molecule data sets
9. Uniform quality constrained gaussian basis sets
10. Pseudoatom expansions of the first-row diatomic hydride electron densities
11. Estimation of ionicity coefficients in Li2BeF4 crystals by X-ray diffraction