Articles with "thermodynamic driving" as a keyword



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Thermodynamic driving force in the formation of hexagonal-diamond Si and Ge nanowires

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Published in 2021 at "Applied Surface Science"

DOI: 10.1016/j.apsusc.2021.148948

Abstract: Abstract The metastable hexagonal-diamond phase of Si and Ge (and of SiGe alloys) displays superior optical properties with respect to the cubic-diamond one. Based on first-principle calculations we show that the surface energy of the… read more here.

Keywords: hexagonal diamond; force formation; thermodynamic driving; diamond ... See more keywords
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Selective metathesis synthesis of MgCr2S4 by control of thermodynamic driving forces

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Published in 2020 at "Materials horizons"

DOI: 10.1039/c9mh01999e

Abstract: MgCr2S4 thiospinel is predicted to be a compelling Mg-cathode material, but its preparation via traditional solid-state synthesis methods has proven challenging. Wustrow et al. [Inorg. Chem., 2018, 57, 14] found that the formation of MgCr2S4… read more here.

Keywords: thermodynamic driving; metathesis reaction; mgcr2s4; synthesis ... See more keywords

OptMDFpathway: Identification of metabolic pathways with maximal thermodynamic driving force and its application for analyzing the endogenous CO2 fixation potential of Escherichia coli

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Published in 2018 at "PLoS Computational Biology"

DOI: 10.1371/journal.pcbi.1006492

Abstract: Constraint-based modeling techniques have become a standard tool for the in silico analysis of metabolic networks. To further improve their accuracy, recent methodological developments focused on integration of thermodynamic information in metabolic models to assess… read more here.

Keywords: thermodynamic driving; escherichia coli; co2 fixation; co2 ... See more keywords