calculating bond orders/Wiberg Indices ?
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Dear All,
What information is needed to calculate bond orders/Wiberg indices ?
I have a full Mulliken population analysis available: is that enough ?
yours hopefully,
john upham
John Upham, Dept. of Chemistry, University of Reading, Berks., RG6 2AD, UK.
Email: scsupham%reading.ac.uk at.at uk.ac (BITnet), scsupham at.at uk.ac.reading
(Janet)
Voice: +44 734 875123 x7441 (day), Fax: +44 734 311610
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John Upham, Dept. of Chemistry, University of Reading, Berks., RG6 2AD, UK.
Email: scsupham%reading.ac.uk at.at uk.ac (BITnet), scsupham at.at uk.ac.reading
(Janet)
Voice: +44 734 875123 x7441 (day), Fax: +44 734 311610