Investigating CH4Thermal Activation in Clathrate Nanocages

© Published under licence by IOP Publishing Ltd. The energy levels of methane molecule trapped, at low temperature, in small (s) and large (l) nano-cages of cubic sI clathrates are calculated in the Born-Oppenheimer approximation using the Extended Lakhlifi-Dahoo model based on pairwise atom-atom ef...

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Bibliographic Details
Main Authors: Lakhlifi, A., Dahoo, P., Meis, C., Gale, Julian
Format: Conference Paper
Published: 2017
Online Access:http://hdl.handle.net/20.500.11937/65432