Results 131 to 140 of about 811,445 (252)

Accelerating multiscale electronic stopping power predictions with time-dependent density functional theory and machine learning

open access: yesnpj Computational Materials
Knowing the rate at which particle radiation releases energy in a material, the “stopping power,” is key to designing nuclear reactors, medical treatments, semiconductor and quantum materials, and many other technologies.
Logan Ward   +5 more
doaj   +1 more source

Excited state polarizabilities of conjugated molecules calculated using time dependent density functional theory [PDF]

open access: green, 2001
Ferdinand C. Grozema   +4 more
openalex   +1 more source

The Difference between Plasmon Excitations in Chemically Heterogeneous Gold and Silver Atomic Clusters

open access: yesMolecules
Weak doping can broaden, shift, and quench plasmon peaks in nanoparticles, but the mechanistic intricacies of the diverse responses to doping remain unclear.
Fanjin Zeng   +5 more
doaj   +1 more source

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