Mb82- (M = Be, Mg, Ca, Sr, and Ba): Planar octacoordinate alkaline earth metal atoms enclosed by boron rings

Science China Chemistry

Volumn 53, Issue 8, 2010, Pages 1737-1745

  Pu, Zhifeng ^a   Ge, Maofa ^a   Li, Qianshu ^b  

^a INSTITUTE OF CHEMISTRY   (China)

^b SOUTH CHINA NORMAL UNIVERSITY   (China)

Author keywords

Alkaline earth metal; Aromatic; Density functional theory; Molecular orbital; Octacoordinate

Indexed keywords

ALKALINE EARTH METAL ATOMS; AROMATIC; AROMATICITIES; DENSITY FUNCTIONAL THEORY METHODS; DENSITY FUNCTIONALS; GLOBAL MINIMA; NUCLEUS-INDEPENDENT CHEMICAL SHIFTS; OCTACOORDINATE; OUT-OF-PLANE; VIBRATIONAL FREQUENCIES;

AROMATIC COMPOUNDS; AROMATIZATION; ATOMS; BARIUM; BERYLLIUM; BORON; BORON COMPOUNDS; CHEMICAL BONDS; MAGNESIUM PRINTING PLATES; METALS; MOLECULAR MODELING; MOLECULAR ORBITALS;

DENSITY FUNCTIONAL THEORY;

EID: 77957974828     PISSN: 16747291     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11426-010-4037-5     Document Type: Article

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