Articles with "porous crystals" as a keyword



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Two-dimensional group-VA porous crystals: Diverse electronic structures and photocatalytic properties

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Published in 2018 at "Computational Materials Science"

DOI: 10.1016/j.commatsci.2018.08.013

Abstract: Abstract The two-dimensional materials (2D) have been widely investigated due to their unique properties. In this paper, based on DFT calculations, a family of novel 2D group-VA porous crystals have been explored, which are named… read more here.

Keywords: dimensional group; crystals diverse; group porous; porous crystals ... See more keywords
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Increasing topological diversity during computational “synthesis” of porous crystals: how and why

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Published in 2019 at "CrystEngComm"

DOI: 10.1039/c8ce01637b

Abstract: Effectively tuning the properties of porous crystals could lead to breakthroughs in areas such as molecular separation, chemical sensing, and catalysis. read more here.

Keywords: porous crystals; computational synthesis; topological diversity; diversity computational ... See more keywords
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Unusual porous crystals via catenation of 1D ladders: unprecedented mixture effects on the adsorption of xylene isomers in a SCSC mode

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Published in 2021 at "CrystEngComm"

DOI: 10.1039/d0ce01458c

Abstract: Self-assembly of silver(I) perchlorate with a C3-symmetric tridentate N-donor ligand produces stable crystals with open channels via catenation of 1D ladder-type coordination polymers. The open-channel crystal shows both unprecedented mixture and temperature effects on the… read more here.

Keywords: via catenation; porous crystals; unprecedented mixture; scsc mode ... See more keywords