Ab initio modelling of methane hydrate thermophysical properties

Using density functional theory, the second-order elastic constants, heat capacity, compressibility, and thermal expansion coefficient of methane hydrate were calculated.

Bibliographic Details
Published in:Physical Chemistry Chemical Physics
Main Authors: Jendi, Z. M., Servio, P., Rey, A. D.
Other Authors: American Chemical Society Petroleum Research Fund
Format: Article in Journal/Newspaper
Language:English
Published: Royal Society of Chemistry (RSC) 2016
Subjects:
Methane hydrate
Online Access:http://dx.doi.org/10.1039/c5cp06530e
http://pubs.rsc.org/en/content/articlepdf/2016/CP/C5CP06530E
Description
Summary:Using density functional theory, the second-order elastic constants, heat capacity, compressibility, and thermal expansion coefficient of methane hydrate were calculated.

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