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Now showing items 81-90 of 111
On the density functional relationship between static dipole polarizability and global softness
(American Chemical Society, 1998)
Static dipole polarizabilities through density functional methods
(American Chemical Society, 1997)
Molecular electronic excitations and the minimum polarizability principle
(American Chemical Society, 2000)
Chemical bonding and reactivity: A local thermodynamic viewpoint
(Elsevier, 1999)
Basis set superposition error in atomic cluster calculations
(Elsevier, 1999)
Interaction of Nitroxide Radicals with an Au8 Nanostructure: Theoretical and Calorimetric Studies
(American Chemical Society, 2019)
Predicting deprotonation sites using alchemical derivatives
(American Chemical Society, 2020)