Geometry and binding properties of different multiple-state glycine-Fe +/Fe2+ complexes

Journal of Physical Organic Chemistry

Volumn 18, Issue 1, 2005, Pages 26-34

  Ai, Hongqi ^a   Bu, Yuxiang ^a,b,c   Li, Ping ^a   Li, Zhiqiang ^a   Hu, Xiangquan ^b   Chen, Zhida ^b  

^a SHANDONG UNIVERSITY   (China)

^b PEKING UNIVERSITY   (China)

^c QUFU NORMAL UNIVERSITY   (China)

Author keywords

Binding energies; Binding energy analysis; DFT calculations; Glycine Fe+ Fe2+ complexes; Relative energies; Structures

Indexed keywords

BINDING ENERGY; COMPUTATIONAL GEOMETRY; COMPUTATIONAL METHODS; ELECTROSTATICS; ISOMERS; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY;

BINDING ENERGY ANALYSIS; DFT CALCULATIONS; GLYCINE-FE+/FE2+ COMPLEXES; RELATIVE ENERGIES; STRUCTURES;

COMPLEXATION;

EID: 10944242311     PISSN: 08943230     EISSN: None     Source Type: Journal    
DOI: 10.1002/poc.808     Document Type: Article

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