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