The pressure-induced transition in solid para-H2 from free rotation of molecules to libration around the threefold axes of the fcc structure is calculated using an anisotropic potential including quadrupole-quadrupole and repulsive valence interactions. The rotational part of the Hamiltonian is assu
โฆ LIBER โฆ
Temperature Effects on the Absorption Spectra of Li in Solid H2 Under High Pressure: A Path Integral Monte Carlo Study
โ Scribed by Y. M. Ma; T. Cui; G. T. Zou
- Book ID
- 110310127
- Publisher
- Springer US
- Year
- 2001
- Tongue
- English
- Weight
- 266 KB
- Volume
- 124
- Category
- Article
- ISSN
- 0022-2291
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Monte-Carlo simulations are used to investigate the effects of multiple ionization on the formation of HO ร 2 /O ร ร 2 and H 2 O 2 in the radiolysis of water by 12 C 6รพ ions up to $430 keV/lm, at neutral pH and 25 ยฐC. Taking into account the double and triple ionizations of water molecules, the prima