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1.
Heliyon ; 10(5): e26441, 2024 Mar 15.
Article in English | MEDLINE | ID: mdl-38455566

ABSTRACT

Reinjecting produced methane offers cost-efficiency and environmental benefits for enhances oil recovery. High minimum miscibility pressure (MMP) in methane-oil systems poses a challenge. To overcome this, researchers are increasingly focusing on using surfactants to reduce MMP, thus enhancing the effectiveness of methane injections for oil recovery. This study investigated the impact of pressure and temperature on the equilibrium interfacial tension of the CH4+n-decane system using molecular dynamics simulations and the vanishing interfacial tension technique. The primary goal was to assess the potential of surfactants in lowering MMP. Among four tested surfactants, ME-6 exhibited the most promise by reducing MMP by 14.10% at 373 K. Key findings include that the addition of ME-6 enriching CH4 at the interface, enhancing its solubility in n-decane, improving n-decane diffusion capacity, CH4 weakens n-decane interactions and strengthens its own interaction with n-decane. As the difference in interactions of n-decane with ME-6's ends decreases, the system trends towards a mixed phase. This research sets the stage for broader applications of mixed-phase methane injection in reservoirs, with the potential for reduced gas flaring and environmental benefits.

2.
J Mol Graph Model ; 119: 108394, 2023 03.
Article in English | MEDLINE | ID: mdl-36527957

ABSTRACT

The benefits of large reserves, wide distribution, and high combustion energy density of natural gas hydrates are of great practical importance to alleviate the energy tension, enhance the existing energy system in China and reduce the greenhouse effect. The CO2 replacement method is a critical way to develop natural gas hydrate, while traditional experimental methods are difficult to reveal the microscopic mechanism of the replacement system. An MD (molecular dynamics) technique was utilized in this work to simulate the process of carbon dioxide replacement of gas hydrates. This simulation investigates the effects of temperature, pressure, and CO2 purity during the CO2 replacement process. CO2, different concentrations of CO2/H2O, and CO2/NH3 are used as the injected fluid. The simulation results show that the influence of temperature on the CO2 replacement of natural gas hydrate is more significant than that of pressure. Within the temperature and pressure range specified in the simulation, H2O inhibits the replacement of CO2, owing to the inhibitory effect increasing as the concentration of H2O increases; NH3 promotes the process of CO2 replacement under the temperature conditions of 250 K and 260 K, and the promotion effect becomes more significant as the concentration of NH3 increases. However, adding NH3 inhibits the CO2 replacement process with hydrate when the temperature lifts to 270 K. These findings provide new ideas to improve the efficiency of the CO2 replacement method and provide theoretical insight for the engineering exploitation of hydrates.


Subject(s)
Carbon Dioxide , Molecular Dynamics Simulation , Water , Natural Gas , Methane
3.
Sheng Wu Gong Cheng Xue Bao ; 30(1): 6-17, 2014 Jan.
Article in Chinese | MEDLINE | ID: mdl-24818475

ABSTRACT

With the current accumulation of metagenome data, it is possible to build an integrated platform for processing of rigorously selected metagenomic samples (also referred as "metagenomic communities" here) of interests. Any metagenomic samples could then be searched against this database to find the most similar sample(s). However, on one hand, current databases with a large number of metagenomic samples mostly serve as data repositories but not well annotated database, and only offer few functions for analysis. On the other hand, the few available methods to measure the similarity of metagenomic data could only compare a few pre-defined set of metagenome. It has long been intriguing scientists to effectively calculate similarities between microbial communities in a large repository, to examine how similar these samples are and to find the correlation of the meta-information of these samples. In this work we propose a novel system, Meta-Mesh, which includes a metagenomic database and its companion analysis platform that could systematically and efficiently analyze, compare and search similar metagenomic samples. In the database part, we have collected more than 7 000 high quality and well annotated metagenomic samples from the public domain and in-house facilities. The analysis platform supplies a list of online tools which could accept metagenomic samples, build taxonomical annotations, compare sample in multiple angle, and then search for similar samples against its database by a fast indexing strategy and scoring function. We also used case studies of "database search for identification" and "samples clustering based on similarity matrix" using human-associated habitat samples to demonstrate the performance of Meta-Mesh in metagenomic analysis. Therefore, Meta-Mesh would serve as a database and data analysis system to quickly parse and identify similar


Subject(s)
Computational Biology/methods , Databases, Genetic , Metagenomics/methods , Cluster Analysis , Humans , Metagenome
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