Julius Jellinek
Argonne National Laboratory
127 Papers
1.2K Citations
Julius Jellinek is an academic researcher from Argonne National Laboratory. The author has contributed to research in topics: Cluster (physics) & Density functional theory. The author has an hindex of 39, co-authored 123 publications. Previous affiliations of Julius Jellinek include University of Brasília & University of Chicago.
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Papers
Pressure and size effects in endohedrally confined hydrogen clusters
TL;DR: The pressure-induced changes in the HOMO-LUMO gap of the clusters indicate a finite-size analog of the pressure-driven metallization of the bulk hydrogen.
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Investigating the metallic behavior of Na clusters using site-specific polarizabilities
TL;DR: A site-specific analysis based on density functional theory is used to investigate the static polarizability response of Na${}_{N}$ clusters for $N$ up to 80 as mentioned in this paper.
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Spectral simulations of polar diatomic molecules immersed in He clusters: application to the ICl (X) molecule
Pablo Villarreal,M. P. de Lara-Castells,Rita Prosmiti,Gerardo Delgado-Barrio,D. López-Durán,Franco A. Gianturco,Julius Jellinek +6 more
TL;DR: In this article, a quantum-chemistry-like methodology to study molecules solvated in atomic clusters is applied to the ICl (iodine chloride) polar diatomic molecule immersed in clusters of He atoms.
REACTION DYNAMICS OF Nin (n =19 and 20) WITH D2: DEPENDENCE ON CLUSTER SIZE, TEMPERATURE AND INITIAL ROVIBRATIONAL STATES OF THE MOLECULE
TL;DR: In this paper, the dependence of cluster reactivity on the cluster temperature and the initial rovibrational states of the molecule using quasiclassical molecular dynamics simulations was investigated, and the results showed that reaction cross-sections strongly depend on the collision energies below 1 eV.
15
Theoretical determination of electron binding energy spectra of anionic magnesium clusters
TL;DR: A recently developed accurate scheme for converting the single-particle eigenenergies of the density functional theory into electron binding energies is used to compute the spectra of electron binding energy in % MathType!MTEF!2!1!+-profile as discussed by the authors.
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