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Autor:
Gareth S. Parkinson, Cesare Franchini, Michael Schmid, Matthias Meier, Ulrike Diebold, Jiri Pavelec, Florian Kraushofer, Jan Balajka, Zdenek Jakub
Publikováno v:
Nature Communications
Nature Communications, Vol 12, Iss 1, Pp 1-8 (2021)
NATURE COMMUNICATIONS. 2021, vol. 12, issue 1, p. 1-8.
Nature Communications, Vol 12, Iss 1, Pp 1-8 (2021)
NATURE COMMUNICATIONS. 2021, vol. 12, issue 1, p. 1-8.
Oxygen exchange at oxide/liquid and oxide/gas interfaces is important in technology and environmental studies, as it is closely linked to both catalytic activity and material degradation. The atomic-scale details are mostly unknown, however, and are
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::61ba2500503afe042d971ff0d46b26b7
BiVO4, a visible-light response photocatalyst, has shown tremendous potential because of abundant raw material sources, good stability and low cost. There exist some limitations for further applicaitions due to poor capability to separate electron–
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1df4cc9009ea6ab5668f41b2f5119a8f
Machine-learning potentials for materials, namely the moment tensor potentials (MTPs), were validated using experimental EXAFS spectra for the first time. The MTPs for four metals (bcc W and Mo, fcc Cu and Ni) were obtained by the active learning alg
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7696f06dcd022f11f0aae7d9455d7e8e
Autor:
Ming Dong, Han Zhang, Dimitrios G. Papageorgiou, Emiliano Bilotti, Lazaros Tzounis, Giovanni Santagiuliana
Publikováno v:
Carbon
Epoxy resins are thermosetting polymers with an extensive set of applications such as anticorrosive coatings, adhesives, matrices for fibre reinforced composites and elements of electronic systems for automotive, aerospace and construction industries
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9a4a078717e7291cdd3c3e7fdca71c26
Molecules adsorbing on metal surfaces form a variety of different surface polymorphs. How strongly this polymorphism affects interface properties is a priori unknown. In this work we investigate how strongly the surface polymorphism influences the in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::eddbf040402afd4a350d644d75e52556
Publikováno v:
Nano Letters
Metal/Insulator/Metal nanocavities (MIMs) are highly versatile systems for nanometric light confinement and waveguiding, and their optical properties are mostly interpreted in terms of surface plasmon polaritons. Although classic electromagnetic theo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5e18c54e61c67ad34fb49fd4db0c7c0e
Autor:
Károly Németh
A radical anion based functionalization of the basal plane of two-dimensional (2D) materials is proposed in the present study. Simple charge neutral radical functionalizations typically detach from the basal planes upon reduction. For example, epoxy
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::088b11d1f33e68ad9c2e45fd569baab5
Autor:
Alexei Kuzmin, Robert A. Evarestov
Publikováno v:
Journal of Computational Chemistry
The authors acknowledge the assistance of the University Computer Center of Saint‐Petersburg State University in the accomplishment of high‐performance computations. A.K. is grateful to the Latvian Council of Science project no. lzp‐2018/2‐03
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::25fe5256354e495d6d17dc4901a94d8f
Publikováno v:
2D materials
Motivated by the recent synthesis of two-dimensional $\alpha$-Fe$_2$O$_3$ [Balan $et$ $al.$ Nat. Nanotech. 13, 602 (2018)], we analyze the structural, vibrational, electronic and magnetic properties of single- and few-layer $\alpha$-Fe$_2$O$_3$ compa
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3c9cb8fbf98dd281f0b8346de8205f4d
Autor:
Daniel Rossi, Mohit Khurana, Jinwoo Cheon, Dong Hee Son, Kwanpyo Kim, Xiaohan Liu, Joseph Puthenpurayil, Alexey V. Akimov, Yangjin Lee
Dark ground state exciton in semiconductor nanocrystals has been a subject of much interest due to its long lifetime attractive for applications requiring long-lived electronic or spin states. Significant effort has been made recently to explore and
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b4bdd1329715f6fd6267db092eace577