Doping-Induced Electronic/Ionic Engineering to Optimize the Redox Kinetics for Potassium Storage: A Case Study of Ni-Doped CoSe2.
Sign Up to like & getrecommendations! Published in 2022 at "Advanced science"
DOI: 10.1002/advs.202200341
Abstract: Heteroatom doping effectively tunes the electronic conductivity of transition metal selenides (TMSs) with rapid K+ accessibility in potassium ion batteries (PIBs). Although considerable efforts are dedicated to investigating the relationship between the doping strategy and… read more here.
Keywords: doping induced; engineering; doped cose2; induced electronic ... See more keywords
Induced electronic changes at the fluorinated polyphenylthiols on nanostructured Au(1 1 1) interfaces
Sign Up to like & getrecommendations! Published in 2018 at "Applied Surface Science"
DOI: 10.1016/j.apsusc.2018.05.008
Abstract: Abstract A detailed analysis of fluorinated polyphenylthiols adsorbed on a nanostructured Au(1 1 1) is performed on the basis of first principle calculations to understand the interface at the atomic level. Our analysis is focused on the… read more here.
Keywords: electronic changes; fluorinated polyphenylthiols; nanostructured interfaces; changes fluorinated ... See more keywords
Nonmetal doping induced electronic and magnetic properties in MoSe 2 monolayer
Sign Up to like & getrecommendations! Published in 2018 at "Chemical Physics Letters"
DOI: 10.1016/j.cplett.2017.12.010
Abstract: Abstract We have systematically investigated the electronic structures and magnetic properties of nonmetal doped MoSe2 monolayer by using spin-polarized density functional theory calculations. Formation energies reveal that all doped systems are thermodynamically preferred under Mo-rich… read more here.
Keywords: mose2 monolayer; nonmetal doping; monolayer; magnetic properties ... See more keywords
Metallic interface induced by electronic reconstruction in crystalline-amorphous bilayer oxide films
Sign Up to like & getrecommendations! Published in 2019 at "Science Bulletin"
DOI: 10.1016/j.scib.2019.08.026
Abstract: https://doi.org/10.1016/j.scib.2019.08.026 2095-9273/ 2019 Science China Press. Published by Elsevier B.V. and Science China Press. All rights reserved. ⇑ Corresponding authors. E-mail addresses: [email protected] (X. Lü), [email protected] (Q. Jia). Xujie Lü a,⇑, Aiping Chen , Yaomin… read more here.
Keywords: interface induced; metallic interface; induced electronic; crystalline amorphous ... See more keywords
Defect-Induced Electronic Structure Changes in Cesium Lead Halide Nanocrystals
Sign Up to like & getrecommendations! Published in 2019 at "Microscopy and Microanalysis"
DOI: 10.1017/s1431927619004033
Abstract: 1. Institute of Materials Science & Engineering, Washington University in St. Louis, St. Louis MO, USA. 2. Center for Nanophase Materials Sciences, Oak Ridge National Laboratory, Oak Ridge, TN, USA. 3. Department of Mechanical Engineering… read more here.
Keywords: defect induced; engineering; materials science; induced electronic ... See more keywords
Understanding Beam Induced Electronic Excitations in Materials.
Sign Up to like & getrecommendations! Published in 2020 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.9b00792
Abstract: Optical electronic absorption spectroscopy and corresponding selection rules have played a prominent role in the development of the theory of electronic structure of materials. In this work, we expand the modern toolbox of chemistry and… read more here.
Keywords: charged particles; point charge; electronic excitations; induced electronic ... See more keywords
Moiré-induced electronic structure modifications in monolayer V2S3 on Au(111)
Sign Up to like & getrecommendations! Published in 2021 at "Physical Review B"
DOI: 10.1103/physrevb.103.115414
Abstract: There is immense interest in how the local environment influences the electronic structure of materials at the single-layer limit. We characterize moir\'e induced spatial variations in the electronic structure of in situ grown monolayer ${\mathrm{V}}_{2}{\mathrm{S}}_{3}$… read more here.
Keywords: spectroscopy; moir induced; electronic structure; induced electronic ... See more keywords