Ab initio calculation of magnetic properties of CO, the equilibrium geometry and the 13C, 17O and 27Al NMR shielding tensors of the system

1983 ◽  
Vol 98 (6) ◽  
pp. 541-544 ◽  
Author(s):  
Th. Weller ◽  
W. Meiler ◽  
H.-J. Köhler ◽  
H. Lischka ◽  
R. Höller
Keyword(s):  
Magnetic Properties ◽  
Ab Initio ◽  
Ab Initio Calculation ◽  
Equilibrium Geometry ◽  
27Al Nmr ◽  
Shielding Tensors

Ab initio calculation of the equilibrium geometry and the 13C, 17O and 27A1 NMR chemical shielding tensors of the system Al3+/CO

1982 ◽  
Vol 72 (1-2) ◽  
pp. 155-159 ◽  
Author(s):  
Th. Weller ◽  
W. Meiler ◽  
A. Michael ◽  
H.J. Köhler ◽  
H. Lischka ◽  
...  
Keyword(s):  
Ab Initio ◽  
Ab Initio Calculation ◽  
Equilibrium Geometry ◽  
Chemical Shielding ◽  
Shielding Tensors

Ab initio calculation of magnetic properties of p-block element doped ZnO

RSC Advances ◽  
2014 ◽  
Vol 4 (85) ◽  
pp. 45598-45602 ◽  
Author(s):  
Palash Nath ◽  
Anirban Chakraborti ◽  
D. Sanyal
Keyword(s):  
Magnetic Properties ◽  
Ab Initio ◽  
Magnetic Moment ◽  
Ab Initio Calculation ◽  
Effective Magnetic Moment ◽  
Block Element ◽  
System P ◽  
Doped Zno

Effective magnetic moment for Zn54O53X (X = B, C, N, F, Al, Si, P, Cl, Ga, Ge, As) system.

Magnetic properties of some metastable Co–Ru alloys studied by ion beam mixing and ab initio calculation

2009 ◽  
Vol 94 (13) ◽  
pp. 131903 ◽  
Author(s):  
W. C. Wang ◽  
Y. Dai ◽  
T. L. Wang ◽  
J. H. Li ◽  
X. He ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Ab Initio ◽  
Ab Initio Calculation ◽  
Ion Beam ◽  
Ion Beam Mixing
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