The Effect of Axial Mg Ligation on the Geometry and Spin Density Distribution of Chlorophyll and Bacteriochlorophyll Cation Free Radical Models:  A Density Functional Study

2001 ◽  
Vol 123 (44) ◽  
pp. 11042-11046 ◽  
Author(s):  
Patrick J. O'Malley ◽  
Simon J. Collins
Keyword(s):  
Free Radical ◽  
Density Distribution ◽  
Spin Density ◽  
Density Functional ◽  
Spin Density Distribution ◽  
Functional Study ◽  
Density Functional Study

Spin-density distribution of the high T c p -O 2 N·C 6 F 4 ·CNSSN free radical studied by polarised neutron diffraction

Polyhedron ◽  
2003 ◽  
Vol 22 (14-17) ◽  
pp. 2301-2305 ◽  
Author(s):  
Javier Luzón ◽  
Javier Campo ◽  
Fernando Palacio ◽  
Garry J McIntyre ◽  
Andrés E Goeta ◽  
...  
Keyword(s):  
Free Radical ◽  
Neutron Diffraction ◽  
Density Distribution ◽  
Spin Density ◽  
Spin Density Distribution

scholarly journals Current-spin-density-functional study of persistent currents in quantum rings

2000 ◽  
Vol 62 (16) ◽  
pp. 10668-10673 ◽  
Author(s):  
S. Viefers ◽  
P. Singha Deo ◽  
S. M. Reimann ◽  
M. Manninen ◽  
M. Koskinen
Keyword(s):  
Spin Density ◽  
Density Functional ◽  
Functional Study ◽  
Persistent Currents ◽  
Density Functional Study ◽  
Quantum Rings
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