2019
DOI: 10.1021/acs.energyfuels.8b04410
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Effects of N and S Functionalities on Binary Gas Co-adsorption on a Coal Macromolecule

Abstract: Effects of N and S functionalities on co-adsorption of CH 4 + N 2 and CH 4 + CO 2 on the coal vitrinite macromolecule model (CVMM) were explored using molecule simulation. Inclusion of the sulfoxide, amine, and sulfide functionalities can enhance S CO 2 /CH 4 (selectivity of CO 2 over CH 4 ), while the pyrrole and pyridine functionalities could not. The higher mole fraction of CO 2 could reduce the pressure required to reach the stable equilibrium state as well as S CO 2 /CH 4 . Microporous calculation results… Show more

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Cited by 26 publications
(16 citation statements)
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“…where μ is a random number in the [−1, 1], A υ is the average of the pulse loudness of all bats at the current iteration number, and M is the dimension of search space. (5) In the iteration process, if the fitness F(S qM ) of bat q is superior to the fitness F(S * ) of optimal bat S * , the basic parameters of bat q should be updated: (6) If the iteration results satisfied the search termination conditions, the optimal solution was S * , the corresponding fitness function was F(S * ), and the corresponding parameters w and b were the optimal parameter values. Otherwise, go back to step (3) and continue iterating through the search until the termination condition was met.…”
Section: Bat Algorithm Optimizing Extreme Learning Machinementioning
confidence: 99%
See 1 more Smart Citation
“…where μ is a random number in the [−1, 1], A υ is the average of the pulse loudness of all bats at the current iteration number, and M is the dimension of search space. (5) In the iteration process, if the fitness F(S qM ) of bat q is superior to the fitness F(S * ) of optimal bat S * , the basic parameters of bat q should be updated: (6) If the iteration results satisfied the search termination conditions, the optimal solution was S * , the corresponding fitness function was F(S * ), and the corresponding parameters w and b were the optimal parameter values. Otherwise, go back to step (3) and continue iterating through the search until the termination condition was met.…”
Section: Bat Algorithm Optimizing Extreme Learning Machinementioning
confidence: 99%
“…With depletion of shallow coal resources, the mining depth of coal mines in China increases. e coupling effect of great in situ stress and high gas pressure in deep coal seam increases the risk of gas outbursts [1][2][3][4][5]. e residual gas content is an important parameter for gas outburst prediction.…”
Section: Introductionmentioning
confidence: 99%
“…The presplitting blasting method has high risks during the implementation process, which is confronted to many governing policies and laws of China [15,16]. Gas injection will increase the content of injected gas (CO 2 or N 2 ), which may lead to new hazards after eliminating gas (methane) outburst risk [17][18][19][20]. This method has little utilization by now [21,22].…”
Section: Introductionmentioning
confidence: 99%
“…Wang et al [17] investigated key mining technologies and equipment of LMTCCM in extra-thick coal seams and successfully applied to Tashan coal mine. By building numerical model and field measurement, Si et al [18] and Fan et al [19] determined the gas dynamics characteristics in multilevel longwall top coal caving of extra-thick coal seams.…”
Section: Introductionmentioning
confidence: 99%