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Browsing Research, Scholarship, Creative Activity by Subject "Density functional theory simulations"
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Locating Si atoms in Si-doped boron carbide: A route to understand amorphization mitigation mechanism (Elsevier, 2018)he well-documented formation of amorphous bands in boron carbide (B4C) under contact loading has been identified in the literature as one of the possible mechanisms for its catastrophic failure. To mitigate amorphization, ...