Structures and stabilities of P5MgnP5 (n = 1-3) compounds containing P5 ligands. Theoretical investigation

Molecular Physics

Volumn 107, Issue 3, 2009, Pages 197-204

  Gong, Liangfa ^a   Wu, Xinmin ^a   Qi, Chuansong ^a   Li, Wei ^a   Xiong, Jieming ^a   Guo, Wenli ^a  

^a BEIJING INSTITUTE OF PETROCHEMICAL TECHNOLOGY   (China)

Author keywords

Binuclear magnesocene; Cyclo P5 ring; Density functional theory; Discrete sandwich structure

Indexed keywords

BASIS SETS; BINUCLEAR MAGNESOCENE; CYCLO-P5 RING; DISCRETE SANDWICH STRUCTURE; MAGNESOCENE; NATURAL BOND ORBITAL; THEORETICAL INVESTIGATIONS;

CHEMICAL BONDS; DYES; LIGANDS; MOLECULAR ORBITALS; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; SANDWICH STRUCTURES;

DENSITY FUNCTIONAL THEORY;

EID: 67651240392     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970902744367     Document Type: Article

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