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First-principles investigation of the electronic, optical, and mechanical properties of β-Si3N4 using rSCAN meta-GGA and DFT-D4 dispersion correction

Source Nature 物理科学13h ago
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Science
Region
Global
Language
English
Item ID
science-7a3b583c

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First-principles investigation of the electronic, optical, and mechanical properties of β-Si3N4 using rSCAN meta-GGA and DFT-D4 dispersion correction · Meridian Globe