Zobrazeno 1 - 10
of 1 057
pro vyhledávání: '"gcmc"'
Publikováno v:
Meitan kexue jishu, Vol 52, Iss 3, Pp 106-114 (2024)
In order to explore the effects of pore size, aromatic lamellar stacking degree, aromatic lamellar ductility, gas temperature and gas pressure on the competitive adsorption of CH4 and CO2, the No.3 coal from Jincheng mining area was taken as the rese
Externí odkaz:
https://doaj.org/article/5df753de6a1a47329b0001bafb495af5
Publikováno v:
Journal of Saudi Chemical Society, Vol 28, Iss 6, Pp 101930- (2024)
This study employs the grand canonical ensemble Monte Carlo (GCMC) method to investigate the effect of small-molecule organic matter on methane adsorption in anthracite. Specifically, the adsorption characteristics of methane in anthracite are analyz
Externí odkaz:
https://doaj.org/article/6ee990f7268840919c8822f4e649a393
Publikováno v:
Energy Reports, Vol 9, Iss , Pp 2852-2860 (2023)
Grand canonical Monte Carlo (GCMC) simulations were used to analyse the effect of -O-Li, -NH2, -SH, -F, -COOH, and -NO2 functional groups on the adsorption and separation of pure CO2 and a mixture of CO2 and CH4. The metal–organic framework (MOF) s
Externí odkaz:
https://doaj.org/article/aa10c74175334665a4bba4eeb9ade3ee
Autor:
Shivanshu Shekhar, Chandra Chowdhury
Publikováno v:
Results in Surfaces and Interfaces, Vol 14, Iss , Pp 100166- (2024)
Gas capture, sensing, and storage systems are all within the capabilities of metal–organic frameworks (MOFs). It is common practise to choose the MOF with the best adsorption property from a large database before running an adsorption calculation.
Externí odkaz:
https://doaj.org/article/db196f83d601414abc3bcc8f15f83cd9
Publikováno v:
Unconventional Resources, Vol 4, Iss , Pp 100071- (2024)
This study investigates the adsorption behavior of carbon dioxide in organic nanopores with different surface roughness. The nanopores are constructed by sinusoidally corrugating the graphite slit pore walls. By computing the density distributions, a
Externí odkaz:
https://doaj.org/article/3239931402324b6094a143f1e3e15658
Publikováno v:
Molecules, Vol 29, Iss 12, p 2880 (2024)
In this study, we present a comprehensive first-principles computational investigation focused on the structural characteristics, electronic properties, and coupling integrations of three cationic Gemini surfactants: 12-4-12, 12-3-12, and 12-2-12 ((C
Externí odkaz:
https://doaj.org/article/6967e8046a4f441cb3ffe6def4e0c6fd
Publikováno v:
Energies, Vol 17, Iss 7, p 1743 (2024)
Western Hunan province and its surrounding areas are significant targets for shale gas exploration and development in southern China, where the black shale of the lower Cambrian Niutitang Formation and Wunitang Formation is extensively distributed. G
Externí odkaz:
https://doaj.org/article/a9b9b5cffb4b4808b398380aa6c69592
Autor:
Chen Zhang, Yiheng Zhang, Tingyu Su, Bingzhi Yuan, Xinqi Zhang, Liwei Wang, Yongqiang Tian, Jiawang Wang
Publikováno v:
Energy Storage and Saving, Vol 2, Iss 2, Pp 435-441 (2023)
Among the different types of CO2 capture technologies for post-combustion, sorption CO2 capture technology with carbon-based sorbents have been extensively explored with the purpose of enhancing their sorption performance by doping hetero elements du
Externí odkaz:
https://doaj.org/article/7fe30a0ec0bf4b078239286e0b963c68
Publikováno v:
Arabian Journal of Chemistry, Vol 16, Iss 12, Pp 105333- (2023)
Doping-modified coal samples can effectively enhance the adsorption of CO2. In order to investigate the micro-mechanism of the adsorption of different gases by the synergistic effect of N/S atomic doping and functional groups in coal, the microporous
Externí odkaz:
https://doaj.org/article/91117aaff61f43f6a74f64fce32b5051
Autor:
Satya Pal Singh, Archana Kumari Singh
Publikováno v:
Results in Physics, Vol 50, Iss , Pp 106554- (2023)
We have elucidated the wetting behaviour of a polar-liquid in contact of an attractive planar surface. The formation of meta-stable liquid column-like structures, separated by vapour phase molecules, forming liquid–vapor interfaces, has been invest
Externí odkaz:
https://doaj.org/article/7f5de6521e934b4196f7cc8d407f6665