Density functional studies of molecular polarizabilities. 7. Anthracene and phenanthrene

International Journal of Molecular Sciences

Volumn 1, Issue 1, 2000, Pages 8-16

  Hinchliffe, Alan ^a   Soscun Machado, Humberto J ^b  

^a UNIVERSITY OF MANCHESTER   (United Kingdom)

^b FACULTAD DE CIENCIAS VETERINARIAS   (Venezuela)

Author keywords

Ab Initio; AM1; Anthracene; Density functional theory; Dipole polarizability; Molecular geometry; Phenanthrene

Indexed keywords

ANTHRACENE; BENZENE; NAPHTHALENE; PHENANTHRENE;

AB INITIO CALCULATION; ARTICLE; ATOM; CORRELATION ANALYSIS; DENSITY FUNCTIONAL THEORY; DIPOLE; ELECTRON; GEOMETRY; MOLECULAR BIOLOGY; POLARIZATION; SCALE UP;

EID: 0006017006     PISSN: 14220067     EISSN: None     Source Type: Journal    
DOI: 10.3390/ijms1010008     Document Type: Article

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