Diamond Nucleation on Hexagonal Boron Nitride: A Theoretical Investigation of the Influence of CH3 and Na Substituents

• The effect of CH3 and Na on diamond nucleation on hexagonal boron nitride (h-BN) was investigated theoretically by using the DFT method. The methyl and sodium species were used as substituents on zigzag edge atoms of the basal plane. Outgrowths correspon

Subject headings

NATURVETENSKAP  -- Kemi -- Oorganisk kemi (hsv//swe)

NATURAL SCIENCES  -- Chemical Sciences -- Inorganic Chemistry (hsv//eng)

Keyword

CHEMICAL-VAPOR-DEPOSITION; EPITAXIAL-GROWTH; THIN-FILMS; CRYSTALLOGRAPHIC ORIENTATIONS; RAMAN MICROPROBE; GAS-PHASE; AB-INITIO; SURFACE; CVD; ENERGETICS

Inorganic chemistry

Oorganisk kemi

Publication and Content Type

ref (subject category)

art (subject category)