Data for exploring the effect of parameters on decomposition of gas hydrate structure I

Publication date: June 2018
Source:Data in Brief, Volume 18
Author(s): Mohammad Fani Kheshty, Farshad Varaminian, Nafiseh Farhadian
This article describes initial and final configurations of methane hydrate structure I as PDB file at various cage occupancies and different temperatures. Cage occupancies from full occupancy to 75% at three temperatures of 290 K, 300 K and 310 K are presented. Dissociation behavior of gas hydrate structure I at the temperature of 300 K is shown in changing the potential energy and radial distribution function.



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