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Volumn 121, Issue 18, 2004, Pages 8973-8982

Structural and electronic evolution of the As(OH)3 molecule in high temperature aqueous solutions: An x-ray absorption investigation

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; ELECTRONIC STRUCTURE; FOURIER TRANSFORMS; HYDRATION; HYDROGEN BONDS; MOLECULAR ORIENTATION; NEUTRON SCATTERING; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PARAMETER ESTIMATION; SHELLS (STRUCTURES); X RAY SPECTROSCOPY;

EID: 9744229245     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1785150     Document Type: Article
Times cited : (52)

References (71)
  • 1
  • 25
    • 9744243748 scopus 로고    scopus 로고
    • note
    • Note that for such low concentrations, the acquisition of diffraction patterns S(q) is impossible.
  • 30
    • 9744286004 scopus 로고    scopus 로고
    • D. Testemale, O. Geaymond, R. Argoud. and J.-L. Hazemann (unpublished)
    • D. Testemale, O. Geaymond, R. Argoud. and J.-L. Hazemann (unpublished).
  • 48
    • 9744270943 scopus 로고    scopus 로고
    • note
    • 3 cluster: these calculations yield a 0.0017 (resp. 0.0022) value at 30°C (resp. 300°C). The small disagreement with our experimental determination (0.0012 and 0.0017 at respective temperatures) is due to the small k range that we used.
  • 50
    • 9744268457 scopus 로고    scopus 로고
    • private communication
    • J.-C. Soetens (private communication).
    • Soetens, J.-C.1
  • 51
    • 9744259797 scopus 로고    scopus 로고
    • M. J. Frisch, G. W. Trucks et al., GAUSSIAN Inc. (2001)
    • M. J. Frisch, G. W. Trucks et al., GAUSSIAN Inc. (2001).
  • 54
    • 9744271966 scopus 로고    scopus 로고
    • note
    • This has been however checked by quantitative determination of the self-absorption effect by use of the FLUO software (FLUO:correcting XANES for self-absorption in fluorescence measurements) by Daniel Haskel, University of Washington. For 0.05m solutions of heavy arsenic atom in light water molecules matrix, the effect is found negligible.
  • 57
    • 9744285243 scopus 로고    scopus 로고
    • note
    • 3 and showed that an opening of the molecule results in a shift of the a 1band towards lower wavenumbers.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.