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On the contribution of intramolecular zero point energy to the equation of state of solid H2Experimental evidence shows that the internal zero-point energy of the H2 molecule exhibits a relatively strong pressure dependence in the solid as well as changing considerably upon condensation. It is shown that these effects contribute about 6% to the total sublimation energy and to the pressure in the solid state. Methods to modify the ab initio isolated pair potential to account for these environmental effects are discussed.
Document ID
19780057514
Acquisition Source
Legacy CDMS
Document Type
Reprint (Version printed in journal)
External Source(s)
Authors
Chandrasekharan, V.
(Paris XIII, Centre Universitaire Villetaneuse, Seine-Saint-Denis, France)
Etters, R. D.
(Colorado State University Fort Collins, Colo., United States)
Date Acquired
August 9, 2013
Publication Date
June 1, 1978
Publication Information
Publication: Journal of Chemical Physics
Volume: 68
Subject Category
Thermodynamics And Statistical Physics
Accession Number
78A41423
Funding Number(s)
CONTRACT_GRANT: NGR-06-002-159
Distribution Limits
Public
Copyright
Other

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