Systematic study on the structures and properties of (Ag2S)n (n = 1–8) clusters
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-019-4191-4
Abstract: Silver sulfide is a famous semiconductor, which can be used in many areas. Understanding the size evolution of silver sulfide clusters is useful in controlling their size to improve their properties in applications. The structures… read more here.
Keywords: study structures; ag2s clusters; structures properties; properties ag2s ... See more keywords
A computational study of structures and catalytic activities of Hoveyda-Grubbs analogues bearing coumarin or isopropoxycoumarin moiety
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DOI: 10.1016/j.catcom.2016.12.014
Abstract: Abstract The DFT/M06-D3 method was used to investigate structures and activation free energies for a series of Hoveyda-Grubbs-like catalysts with the isopropoxybenzene part replaced by coumarin (2H-chromen-2-one) and ten derivatives of isopropoxycoumarin. Out of ten… read more here.
Keywords: structures catalytic; study structures; hoveyda grubbs; computational study ... See more keywords
Theoretical study of the structures of bimetallic Ag–Au and Cu–Au clusters up to 108 atoms
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DOI: 10.1098/rsos.190342
Abstract: The stable structures of Ag–Au and Cu–Au clusters with 1 : 1, 1 : 3 and 3 : 1 compositions with up to 108 atoms are obtained using a modified adaptive immune optimization algorithm with… read more here.
Keywords: 108 atoms; study structures; theoretical study; structures bimetallic ... See more keywords
Numerical study on structures formed by the deposition and solidification of a single molten droplet
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DOI: 10.1139/cjp-2019-0211
Abstract: The formed structure is of importance in determining the surface quality of a component made by droplet-based 3D printing. In the present work, the molten droplet solicitation process was simulated... read more here.
Keywords: structures formed; study structures; formed deposition; molten droplet ... See more keywords
Study of structures made of composite materials used in automotive industry
Sign Up to like & getrecommendations! Published in 2021 at "Proceedings of the Institution of Mechanical Engineers, Part L: Journal of Materials: Design and Applications"
DOI: 10.1177/14644207211019767
Abstract: Composite materials are becoming more and more popular in automotive industry since classical materials are, in general, expensive and deficient. This paper presents a study on how metals, used in the construction of car doors,… read more here.
Keywords: study structures; automotive industry; structures made; composite materials ... See more keywords