Dear ADF users and developers,
 
I have calculated the hyperfine interaction of a Chlorophyll molecule, and the A tensors and its isotropic values of three proton of each methyl group are different as predicted theoretically. However, this leads to the problem how to compare the calculated results with the experiment in which also only one value is given for a methyl group.
 
Thanks in advance,
 
Best regards,

Dr. Yuming Sun
Department of Physics
Yantai University
Yantai, Shandong 264005
P.R. China
Tel. 86-535-6904965
Fax 86-535-6901947

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Received on 2004-05-17 02:02:33