S
Sergei Tretiak
Researcher at Los Alamos National Laboratory
Publications - 475
Citations - 28719
Sergei Tretiak is an academic researcher from Los Alamos National Laboratory. The author has contributed to research in topics: Excited state & Density functional theory. The author has an hindex of 73, co-authored 415 publications receiving 23905 citations. Previous affiliations of Sergei Tretiak include European University of Brittany & University of Central Florida.
Papers
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Photoluminescence imaging of solitary dopant sites in covalently doped single-wall carbon nanotubes
Nicolai F. Hartmann,Sibel Ebru Yalcin,Lyudmyla Adamska,Erik H. Haroz,Xuedan Ma,Sergei Tretiak,Han Htoon,Stephen K. Doorn +7 more
TL;DR: A route to control dopant functionalization to a low level as a means for introducing spatially well-separated solitary dopant sites and confirmation of dopants as trapping sites for localization of E(11) excitons following their diffusive transport to the dopant site.
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Unidirectional Energy Transfer in Conjugated Molecules: The Crucial Role of High-Frequency C≡C Bonds
TL;DR: In this paper, an excited-state nonadiabatic molecular dynamics was used to study energy transfer in dendrimer building blocks, between two-, three-, and four-ring linear polyphenylene ethynylene units linked by meta-substitutions.
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Electronic Properties of DNA Base Molecules Adsorbed on a Metallic Surface
Svetlana Kilina,Sergei Tretiak,Dzmitry Yarotski,Jian-Xin Zhu,Norman Modine,and Antoinette Taylor,Alexander V. Balatsky +6 more
TL;DR: The internal electronic structure of single deoxyribonucleic acid (DNA) base molecules (i.e., guanine, adenine, cytosine, and thymine) adsorbed on a metallic surface of Cu(111) was determined in detail using density functional theory (DFT) computations as discussed by the authors.
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Artifacts due to trivial unavoided crossings in the modeling of photoinduced energy transfer dynamics in extended conjugated molecules
TL;DR: In this paper, the transition from interacting/delocalized states to noninteracting/localized states in oligomers of polyphenylene vinylene separated by varying distances is investigated.
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Excitonic and Vibrational Properties of Single-Walled Semiconducting Carbon Nanotubes**
TL;DR: In this article, the authors review quantum-chemical studies of the excited-state electronic structure of finite-size semiconducting single-walled carbon nanotubes using methodologies previously successfully applied to describe conjugated polymers and other organic molecular materials.