Electrostatic properties of ammonium fluoride and deuterated ice-Ih
نویسندگان
چکیده
منابع مشابه
Diffuse scattering in Ih ice.
Single crystals of ice Ih, extracted from the subglacial Lake Vostok accretion ice layer (3621 m depth) were investigated by means of diffuse x-ray scattering and inelastic x-ray scattering. The diffuse scattering was identified as mainly inelastic and rationalized in the frame of ab initio calculations for the ordered ice XI approximant. Together with Monte-Carlo modelling, our data allowed re...
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چکیده ندارد.
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Several thermodynamic properties of ice Ih, II, and III are studied by a quasi-harmonic approximation and compared to results of quantum path integral and classical simulations. This approximation allows to obtain thermodynamic information at a fraction of the computational cost of standard simulation methods, and at the same time permits studying quantum effects related to zero-point vibration...
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ژورنال
عنوان ژورنال: Canadian Journal of Chemistry
سال: 1996
ISSN: 0008-4042,1480-3291
DOI: 10.1139/v96-104