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Now showing items 21-30 of 111
A theoretical study of alkali metal atomic clusters: From Lin to Csn (n = 2-8)
(John Wiley and Sons Inc., 2009)
Understanding chemical reactivity in extended systems: exploring models of chemical softness in carbon nanotubes
(Peking University Press, 2018)
Local electrophilicity
(Springer Verlag, 2018)
Theoretical study of the surface reactivity of alkaline earth oxides: Local density of states evaluation of the local softness
(AMER INST PHYSICS, 2008-01-17)
Relativistic effects on the hexafluorides of group 10 metals
(ELSEVIER, 2008-05-20)
Atomic Charges and the Electrostatic Potential Are Ill-Defined in Degenerate Ground States
(American Chemical Society, 2013)
Ab Initio Molecular Dynamics Simulations of Ti-2 on C-20 Collisions and C20Ti2 Configurations
(ACS Publications, 2013-02-28)