GeH







 









Germanium


Nuclear Quadrupole Coupling Constants


in Germanium Hydride Radical


 








 


 





  








   







Table 1. 73Ge nqcc's in GeH Radical (MHz).
   






Calc. [a] B3P86/6-311G(2d) model.
Calc. [b] B3PW91 /6-311G(2d) model.
 


Calc. [a]

Calc. [b]
Expt. [1]
   







eQq1 158.81 158.92 158.9(76)
 


 







 
Bond length, re(GeH) = 1.588 Å [2].

 








 








[1] J.M.Brown, K.M.Evenson, and T.J.Sears, J.Chem.Phys. 83,3275 (1985).
[2] K.P.Huber and G.Herzberg, Constants of Diatomic Molecules, Van Nostrand-Reinhold, New York, 1979.
 

 








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Molecules/Germanium

 








 













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