Počet záznamů: 1
Single-particle and collective excitations of polar water molecules confined in nano-pores within a cordierite crystal lattice
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SYSNO ASEP 0566631 Druh ASEP J - Článek v odborném periodiku Zařazení RIV J - Článek v odborném periodiku Poddruh J Článek ve WOS Název Single-particle and collective excitations of polar water molecules confined in nano-pores within a cordierite crystal lattice Tvůrce(i) Belyanchikov, M. A. (RU)
Bedran, Z.V. (RU)
Savinov, Maxim (FZU-D) RID, ORCID
Bednyakov, Petr (FZU-D) RID, ORCID
Proschek, P. (CZ)
Prokleška, J. (CZ)
Abalmasov, V.A. (RU)
Zhukova, E.S. (RU)
Thomas, V.G. (RU)
Dudka, A. (RU)
Zhugayevych, A. (RU)
Petzelt, Jan (FZU-D) RID, ORCID, SAI
Prokhorov, A. S. (RU)
Anzin, V.B. (RU)
Kremer, R. K. (DE)
Fischer, J.K.H. (DE)
Lunkenheimer, P. (DE)
Loidl, A. (DE)
Uykur, E. (DE)
Dressel, M. (RU)
Gorshunov, B. (RU)Celkový počet autorů 21 Zdroj.dok. Physical Chemistry Chemical Physics. - : Royal Society of Chemistry - ISSN 1463-9076
Roč. 24, č. 11 (2022), s. 6890-6904Poč.str. 15 s. Jazyk dok. eng - angličtina Země vyd. GB - Velká Británie Klíč. slova classcial anharmonic-oscillator ; square ise ; dynamic susceptibility ; ferroelectric ice ; quantum ; transition ; diffusion ; behavior ; surface Vědní obor RIV BM - Fyzika pevných látek a magnetismus Obor OECD Condensed matter physics (including formerly solid state physics, supercond.) CEP GA20-01527S GA ČR - Grantová agentura ČR Způsob publikování Omezený přístup Institucionální podpora FZU-D - RVO:68378271 UT WOS 000765408600001 EID SCOPUS 85127200454 DOI 10.1039/d1cp05338h Anotace In the present work, comprehensive broad-band dielectric spectroscopy is combined with specific heat studies and molecular dynamics and Monte Carlo simulations in order to investigate in more detail the collective modes and single-particle excitations of nanoconfined water molecules. From DFT-MD simulations we reconstruct the potential-energy landscape experienced by the H2O molecules. A rich set of anisotropic temperature-dependent excitations is observed in the terahertz frequency range. Their origin is associated with the complex rotational/translational vibrations of confined H2O molecules. A strongly temperature dependent relaxational excitation, observed at radio-microwave frequencies for E||a is analyzed in detail. The temperature dependences of loss-peak frequency and dielectric strength of the excitation together with specific heat data confirm a ferroelectric order–disorder phase transition in the network of H2O dipoles. Additional data are also provided for E||b. Pracoviště Fyzikální ústav Kontakt Kristina Potocká, potocka@fzu.cz, Tel.: 220 318 579 Rok sběru 2023 Elektronická adresa https://doi.org/10.1039/d1cp05338h
Počet záznamů: 1