Boron doping concentrations ≳6×1019 cm−3 were found to increase Si(001) growth rates RSi at low temperatures while decreasing RSi at higher temperatures during gas-source molecular beam epitaxy (GS-MBE) from Si2H6 and B2H6. In order to probe the mechanisms governing these effects, Si(001) samples with B coverages θB ranging from <0.05 to ≂0.5 ML were prepared by exposing clean Si(001)2×1 wafers to B2H6 doses between 2×1017 and 4×1020 cm−2 at 200–400 °C. The samples were then heated to 700 °C to desorb the hydrogen, cooled to 200 °C, and exposed to atomic deuterium until saturation coverage. D2 temperature programmed desorption spectra exhibit β2 and β1 peaks due to dideuteride and monodeuteride desorption at 405 and 515 °C as well as new B-induced peaks, β2* and β1*, at 330 and 470 °C. Increasing θB increases the area under β2* and β1* at the expense of β2 and β1. Moreover, the total D coverage continuously decreases from ≂1.23 ML in the absence of B to ≂0.74 ML at θB=0.5 ML. We propose that the observed B-induced decrease in the Si*-D bond strength, where Si* represents surface Si atoms bonded to second-layer B atoms, is due to charge transfer and increased Si* dimer strain. The Si* to B charge transfer also deactivates Si surface dangling bonds causing the decrease in θD. These results are used to explain the GS-MBE growth kinetics.
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