کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
1754732 1522808 2015 9 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Molecular simulation of natural gas transport and storage in shale rocks with heterogeneous nano-pore structures
ترجمه فارسی عنوان
شبیه سازی مولکولی انتقال و ذخیره گاز طبیعی در سنگ های شیل با ساختارهای نانوذرات ناهمگن
موضوعات مرتبط
مهندسی و علوم پایه علوم زمین و سیارات زمین شناسی اقتصادی
چکیده انگلیسی


• Monte Carlo simulation is applied to study the natural gas storage behavior.
• Molecular dynamics simulation is to investigate the gas transport mechanism.
• Digital rocks are reconstructed using MCMC method.
• Complex geometry strongly affects the gas storage and transport behavior.

Although natural gas is widely produced from shale, the mechanisms of natural gas transport in shale matrices remain poorly understood due to the complex chemical compounds of the matrices and the nanoscale pore size distribution. Using molecular simulations, we investigate natural gas transport and storage in nano-pore networks. Carbon-based 3-D pore networks are generated from 2-D scanning electron microscopy (SEM) images of a shale rock using the Markov Chain Monte Carlo simulation method. We employ a grand canonical Monte Carlo (GCMC) simulation to calculate adsorption isotherms of natural gas in carbon-based 3-D pore networks, which can be fit by a Langmuir isotherm model. To investigate gas transport in the same structures, we insert an external driving force into non-equilibrium molecular dynamics (NEMD) simulations and find that Knudsen diffusion is the dominant transport mechanism in the pore networks. Although porosity and pore connectivity affect the natural gas diffusion in the pore networks, we typically observe a linear relationship between average molar flow rate through a cross-sectional area and the external driving force.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Petroleum Science and Engineering - Volume 133, September 2015, Pages 401–409
نویسندگان
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