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Toplam kayıt 3, listelenen: 1-3
Pressure-induced amorphization, mechanical and electronic properties of zeolitic imidazolate framework (ZIF-8)
(ELSEVIER SCIENCE SA, PO BOX 564, 1001 LAUSANNE, SWITZERLAND, 2020)
Ab initio molecular dynamics (AIMD) simulations are carried out to probe the high-pressure behavior of ZIF-8 over wide pressure-range. Under compression, the enormous distortions in the ZnN4 tetrahedral units lead to a ...
Synthesis of benzotriazole functionalized ZIF-8 by postsynthetic modification for enhanced CH4 and CO2 uptakes
(ELSEVIER, 2022)
In this work, a series of functionalized ZIF-8 were synthesized via incorporation of benzotriazole ligands into the
framework with a post-synthetic method. The crystal structure and porosity were preserved for all ...
Extreme flexibility and unusual piezomechanical properties of zinc-alkyl-based metal-organic frameworks: A first principles study
(ELSEVIER, 2023)
The behavior of three Zn-alkyl-based MOFs, ZnGA (Zn-Glutarate), ZnAA (Zn-Adipate), and ZAG-4 (Zinc Alky Gate), under hydrostatic compression has been investigated using first-principles DFT simulation, which has proven its ...