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...
Published in: | Data in Brief |
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Main Authors: | , , |
Format: | Text |
Language: | English |
Published: |
Elsevier
2018
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Subjects: | |
Online Access: | http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5996948/ https://doi.org/10.1016/j.dib.2018.04.015 |
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. |
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