publications, 2000

8. Grochala W, Hoffmann R
Chemistry of vibronic coupling. 3. How one might maximize off-diagonal dynamic vibronic coupling constants for intervalence charge-transfer (IVCT) states in an ABA system (A, B = alkali metal, H, halogen)?
J PHYS CHEM A 104 (43): 9740-9749 2000

 

7. Grochala W, Albrecht AC, Hoffmann R
Remarkably simple relationship connecting the calculated geometries of isomolecular states of three different multiplicities
J PHYS CHEM A 104 (11): 2195-2203 2000

 

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