Structures and electronic properties of halogenated Au(III) phthalocyanine AuPcX (X = Cl, Br): A Density Functional Theoretical Study
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DOI: 10.1016/j.commatsci.2018.06.007
Abstract: Abstract The structure and electronic property of halogenated Au(III) phthalocyanine AuPcX (X = Cl, Br) have been investigated theoretically with density functional theory (DFT). The calculation results show that the Au cation is coordinated with one halogen… read more here.
Keywords: halogenated iii; density functional; iii phthalocyanine; phthalocyanine aupcx ... See more keywords