Structural quantum isotope effects in amorphous beryllium hydride
- 2 December 2003
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 119 (23) , 12499-12502
- https://doi.org/10.1063/1.1626638
Abstract
The structure factors for amorphous and were measured using synchrotron x-ray and neutron diffraction techniques. The results show that the structure of amorphous is comprised of corner-sharing tetrahedra and is therefore analogous to amorphous and A substantial increase in the height of the first sharp x-ray diffraction peak of compared to is interpreted as a marked increase in the extent of intermediate range order in 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.
Keywords
This publication has 23 references indexed in Scilit:
- Structural Quantum Effects in Hydrogeneous Liquids and Glasses Part II Experiments using Synchrotron RadiationPhysics and Chemistry of Liquids, 2003
- How to build a better pair potential for waterThe Journal of Chemical Physics, 2001
- Isotopic quantum effects in water structure measured with high energy photon diffractionJournal of Physics: Condensed Matter, 2000
- Ab initio treatment of electron correlations in polymers: Lithium hydride chain and beryllium hydride polymerThe Journal of Chemical Physics, 2000
- Quantum effects in simulated water by the Feynman–Hibbs approachThe Journal of Chemical Physics, 1998
- Approximately extensive modifications of the multireference configuration interaction method: A theoretical and practical analysisThe Journal of Chemical Physics, 1995
- Accurate ab initio quartic force fields for borane and BeH2Chemical Physics Letters, 1992
- Lattice dynamics of crystalline beryllium hydrideSolid State Communications, 1989
- A quantum mechanical study of structure in liquid H2O and D2OThe Journal of Chemical Physics, 1985
- Isochoric temperature differential of the x-ray structure factor and structural rearrangements in low-temperature heavy waterPhysical Review A, 1983