Electron population analysis of accurate diffraction data. III. Application of one- and two-center formalisms to tetracyanoethylene oxide

1972 ◽  
Vol 94 (23) ◽  
pp. 8001-8008 ◽  
Author(s):  
D. A. Matthews ◽  
G. D. Stucky ◽  
P. Coppens
Keyword(s):  
Diffraction Data ◽  
Population Analysis ◽  
Electron Population

Electron Population Analysis by Full-Potential X-Ray Absorption Simulations

1999 ◽  
Vol 82 (11) ◽  
pp. 2398-2401 ◽  
Author(s):  
Yves Joly ◽  
Delphine Cabaret ◽  
Hubert Renevier ◽  
Calogero R. Natoli
Keyword(s):  
Population Analysis ◽  
Full Potential ◽  
Electron Population ◽  
X Ray ◽  
X Ray Absorption

Beschreibung der Richtung des elektrischen Dipolmomentvektors 14 durch Slater-Orbitalexponenten, / The Direction of the Electric Dipole Moment Vector μ⃗ as Inferred from Slater Orbital Exponents

1975 ◽  
Vol 30 (7-8) ◽  
pp. 550-553
Author(s):  
Paul Machmer
Keyword(s):  
Dipole Moment ◽  
Electric Dipole Moment ◽  
Electric Dipole ◽  
Population Analysis ◽  
Electron Population ◽  
Slater Orbital ◽  
Moment Vector ◽  
Molecular Ground State ◽  
Heteronuclear Molecules ◽  
Orbital Exponents

By means of Slater orbital exponents it is possible to differentiate between the positive and the negative end of the permanent electric dipole of diatomic heteronuclear molecules. Thus Slater orbital exponents hold a clue to the direction of the electric dipole moment vector μ⃗ of the molecular ground state. A comparison with electron population analysis is made.

scholarly journals Electron Population Analysis and Localization in Simple Molecules and Boron Compounds.

1988 ◽  
Vol 42a ◽  
pp. 530-538 ◽  
Author(s):  
Durward W. J. Cruickshank ◽  
Alexander Chablo ◽  
Miriam Eisenstein ◽  
Paula L. Reidy ◽  
Leiv K. Sydnes ◽  
...  
Keyword(s):  
Population Analysis ◽  
Boron Compounds ◽  
Electron Population ◽  
Simple Molecules
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