Structural quantum isotope effects in amorphous beryllium hydride

The structure factors for amorphous BeD2 and BeH2 were measured using synchrotron x-ray and neutron diffraction techniques. The results show that the structure of amorphous BeD2 is comprised of corner-sharing tetrahedra and is therefore analogous to amorphous H2O and BeF2. A substantial increase in...

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Veröffentlicht in:J. Chem. Phys 2003-12, Vol.119 (23), p.12499-12502
Hauptverfasser: Sampath, Sujatha, Lantzky, Kristina M., Benmore, Chris J., Neuefeind, Jörg, Siewenie, Joan E., Egelstaff, Peter A., Yarger, Jeffery L.
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Sprache:eng
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Zusammenfassung:The structure factors for amorphous BeD2 and BeH2 were measured using synchrotron x-ray and neutron diffraction techniques. The results show that the structure of amorphous BeD2 is comprised of corner-sharing tetrahedra and is therefore analogous to amorphous H2O and BeF2. A substantial increase in the height of the first sharp x-ray diffraction peak of BeD2 compared to BeH2 is interpreted as a marked increase in the extent of intermediate range order in BeD2 due to stronger network formation. A real-space comparison with liquid water, reveals that the structural isotopic quantum effects are quite different in the two hydrides.
ISSN:0021-9606
1089-7690
DOI:10.1063/1.1626638