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Theoretical chemists
American theoretical chemists
Computational chemists
Indian theoretical chemists
Isaiah Shavitt
S. Francis Boys
George G. Hall
Rodney J. Bartlett
Trygve Helgaker
Werner Kutzelnigg
John Wilfrid Linnett
Roy McWeeny
Benjamin Widom
Reinhart Ahlrichs
Per-Olov Löwdin
Stuart A. Rice
R. Stephen Berry
Kenneth Pitzer
Phillip Geissler
Frank A. Weinhold
Isaac B. Bersuker
Teresa Head-Gordon
Bettina G. Keller
Lionel Salem
Mario Barbatti
James L. Skinner
Christel Marian
Mark S Gordon
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