Cu-Si bond and Cl defect synergistical catalysis for SiCl4 dissociation on CuCl2(1 0 0): A DFT study
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DOI: 10.1016/j.apsusc.2020.148777
Abstract: Abstract It is essential to convert SiCl4 into SiHCl3 over effective catalysts so as to construct a close-cycle sustainable polysilicon production process. However, the dissociation mechanism of SiCl4 is elusive yet. Here we adopted density… read more here.
Keywords: dft; dissociation; bond defect; sicl4 ... See more keywords
Adsorption of gas molecules on armchair AlN nanoribbons with a dangling bond defect by using density functional theory
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DOI: 10.1016/j.matchemphys.2016.10.058
Abstract: Abstract In this paper, the adsorption of gas molecules (CO, NO, O 2 , CO 2 , and NO 2 ) on armchair aluminum nitride nanoribbons (AAlNNRs) with a dangling bond defect has been investigated… read more here.
Keywords: dangling bond; adsorption; gas; bond defect ... See more keywords
Flexural Response of CFRP-Strengthened Steel Beams with Initial Bond Defects
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DOI: 10.4186/ej.2020.24.1.115
Abstract: This paper presents the flexural behavior of steel beams strengthened with partial-length adhesive-bonded carbon fiber-reinforced polymer (CFRP) plates under static four-point bending. An initial bond defect was intentionally introduced in the constant moment region of… read more here.
Keywords: steel beams; bond defect; initial bond; steel ... See more keywords