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...

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Detalles Bibliográficos
Autores principales: Kheshty, Mohammad Fani, Varaminian, Farshad, Farhadian, Nafiseh
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2018
Materias:
Chemical Engineering   
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5996948/
https://www.ncbi.nlm.nih.gov/pubmed/29900300
http://dx.doi.org/10.1016/j.dib.2018.04.015
Descripción
Sumario: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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