Dear all,

Josef W. Zwanziger wrote:

> Upon using the QTENS keyword for a boron-containing molecule, the output
> shows that the program is using 0.04059E-24 cm2 for the quadrupole
> moment of the boron-11 nucleus. Is there a literature reference for this
> number? Thanks--
>
>
At the moment ADF uses the values in
Handbook of Chemistry and Physics 75th edition
special student edition, Editor D.R.Lide, CRC Press, Boca Raton, 1994
which were collected by Pekka Pyykko.

Best regards,
Erik van Lenthe
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Dr. Erik van Lenthe, Scientific Computing & Modelling NV
Vrije Universiteit, Theoretische Chemie, De Boelelaan 1083
1081 HV Amsterdam, The Netherlands
Phone: +31 20 44 47625 FAX: +31 20 44 47629
e-mail: vanlenthe@scm.com WWW: http://www.scm.com
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Received on 2004-06-11 11:33:51