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

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 s...

Full description

Bibliographic Details
Published in:Data in Brief
Main Authors: Kheshty, Mohammad Fani, Varaminian, Farshad, Farhadian, Nafiseh
Format: Text
Language:English
Published: Elsevier 2018
Subjects:
Chemical Engineering
Methane hydrate
Online Access:http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5996948/
https://doi.org/10.1016/j.dib.2018.04.015
Description
Summary: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.

Similar Items