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Published in 2022 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.26946
Abstract: Methods rooted in the density functional theory and in the coupled cluster ansatz were employed to investigate the cycloaddition reactions to ethylene and acetylene of 1,3‐dipolar species including ozone and the derivatives issued from replacement…
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Keywords:
so2;
methylide ch2sch2;
valence isoelectronic;
thioformaldehyde methylide ... See more keywords
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Published in 2018 at "International Journal of Hydrogen Energy"
DOI: 10.1016/j.ijhydene.2018.05.174
Abstract: Abstract In this study, the stable operating range and basic characteristics including the pressure and speed of a rotating detonation are researched. The fuel is an “ethylene–acetylene–hydrogen” mixture, examined at three mixing ratios of 2:1:4,…
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Keywords:
rotating detonation;
acetylene hydrogen;
ethylene acetylene;
detonation ... See more keywords
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Published in 2022 at "ACS applied materials & interfaces"
DOI: 10.1021/acsami.2c13500
Abstract: Due to the industrial requirements for high production and high quality of ethylene, efficient purification of ethylene from acetylene and ethane is of prime importance but challenging. Dynamic metal-organic frameworks (MOFs) have demonstrated intriguing structural…
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Keywords:
desolvation degree;
purification;
purification ethylene;
acetylene ethane ... See more keywords