Graphdiyne family-tunable solution to shock resistance
نویسندگان
چکیده
منابع مشابه
Widely tunable band gaps of graphdiyne: an ab initio study.
Functionalization of graphdiyne, a two-dimensional atomic layer of sp-sp(2) hybrid carbon networks, was investigated through first-principles calculations. Hydrogen or halogen atoms preferentially adsorb on sp-bonded carbon atoms rather than on sp(2)-bonded carbon atoms, forming sp(2)- or sp(3)-hybridization. The energy band gap of graphdiyne is increased from ~0.5 eV to ~5.2 eV through the hyd...
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ژورنال
عنوان ژورنال: Materials Research Express
سال: 2020
ISSN: 2053-1591
DOI: 10.1088/2053-1591/abc771