Materials Map

Discover the materials research landscape. Find experts, partners, networks.

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The Materials Map is an open tool for improving networking and interdisciplinary exchange within materials research. It enables cross-database search for cooperation and network partners and discovering of the research landscape.

The dashboard provides detailed information about the selected scientist, e.g. publications. The dashboard can be filtered and shows the relationship to co-authors in different diagrams. In addition, a link is provided to find contact information.

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The Materials Map is still under development. In its current state, it is only based on one single data source and, thus, incomplete and contains duplicates. We are working on incorporating new open data sources like ORCID to improve the quality and the timeliness of our data. We will update Materials Map as soon as possible and kindly ask for your patience.

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University of St Andrews

in Cooperation with on an Cooperation-Score of 37%

Topics

Publications (15/15 displayed)

  • 2024Site-directed cation ordering in chabazite-type Al x Ga 1–x PO 4 -34 frameworks revealed by NMR crystallography1citations
  • 2024Site-directed cation ordering in chabazite-type AlxGa1–xPO4-34 frameworks revealed by NMR crystallography1citations
  • 2024Site-directed cation ordering in chabazite-type Al x Ga 1− x PO 4 -34 frameworks revealed by NMR crystallography1citations
  • 2024Site-directed cation ordering in chabazite-type AlxGa1−xPO4-34 frameworks revealed by NMR crystallography1citations
  • 2023Synthesis of FeAPO-34 molecular sieve under ionothermal condition2citations
  • 2022Synthesis of FeAPO-34 molecular sieve under ionothermal condition2citations
  • 201817 O solid-state NMR spectroscopy of A 2 B 2 O 7 oxides:quantitative isotopic enrichment and spectral acquisition?15citations
  • 201817O solid-state NMR spectroscopy of A2B2O7 oxides15citations
  • 2017A gel aging effect in the synthesis of open-framework gallium phosphates7citations
  • 2017Assembly-diassembly-organization-reassembly synthesis of zeolites based on cfi-type layers62citations
  • 2016Phase Composition and Disorder in La2(Sn,Ti)2O7 Ceramics: New Insights from NMR Crystallographycitations
  • 2016Phase composition and disorder in La2(Sn,Ti)2O7 ceramics16citations
  • 2015Combined theoretical and experimental investigations of porous crystalline materialscitations
  • 2011A co-templating route to the synthesis of Cu SAPO STA-7, giving an active catalyst for the selective catalytic reduction of NOcitations
  • 2011A co-templating route to the synthesis of Cu SAPO STA-7, giving an active catalyst for the selective catalytic reduction of NO40citations

Places of action

Chart of shared publication
Guillou, Nathalie
5 / 17 shared
Marshall, Thomas
2 / 2 shared
Ashbrook, Sharon E.
7 / 9 shared
Walton, Richard
3 / 5 shared
Clayton, Jasmine
2 / 2 shared
Ashbrook, Sharon. E.
6 / 15 shared
Marshall, Thomas H. D.
2 / 2 shared
Walton, Richard I.
2 / 34 shared
Clayton, Jasmine A.
2 / 4 shared
Musa, Mazlina
2 / 2 shared
Morris, Russell E.
3 / 30 shared
Whittle, Karl
3 / 10 shared
Mckay, David
4 / 8 shared
Moran, Robert
2 / 5 shared
Bignami, Giulia P. M.
2 / 2 shared
Blanc, Frédéric
2 / 9 shared
Fernandes, Arantxa
4 / 7 shared
Sneddon, Scott
4 / 11 shared
Tang, Chiu C.
1 / 17 shared
Broom, Lucy
1 / 1 shared
Clarkson, Guy
1 / 1 shared
Hooper, Joseph E.
1 / 1 shared
Opanasenko, Maksym
1 / 4 shared
Morris, Samuel A.
1 / 5 shared
Firth, Daniel S.
1 / 1 shared
Čejka, Jiři
1 / 2 shared
Slawin, Alexandra Martha Zoya
2 / 65 shared
Wheatley, Paul S.
1 / 8 shared
Položij, Miroslav
1 / 3 shared
Mayoral, Alvaro
1 / 9 shared
Nachtigall, Petr
1 / 2 shared
Russell, Samantha E.
1 / 4 shared
Lawson, Sebastian
2 / 4 shared
Whittle, Karl R.
1 / 2 shared
Veazey, Richard
2 / 5 shared
Warrender, Stewart J.
2 / 5 shared
Thompson, Stephen P.
2 / 7 shared
Slawin, Alexandra M.
1 / 1 shared
Hong, Suk Bong
2 / 4 shared
Daturi, Marco
2 / 8 shared
Picone, A. Lorena
2 / 2 shared
Wright, Paul A.
2 / 14 shared
Vimont, Alexandre
2 / 6 shared
Gaberova, Lucia
2 / 2 shared
Moulin, Beatrice
2 / 2 shared
Sung, Sam Kyung
2 / 2 shared
Park, Min Bum
2 / 2 shared
Nam, In-Sik
2 / 3 shared
Llewellyn, Philip L.
1 / 8 shared
Chart of publication period
2024
2023
2022
2018
2017
2016
2015
2011

Co-Authors (by relevance)

  • Guillou, Nathalie
  • Marshall, Thomas
  • Ashbrook, Sharon E.
  • Walton, Richard
  • Clayton, Jasmine
  • Ashbrook, Sharon. E.
  • Marshall, Thomas H. D.
  • Walton, Richard I.
  • Clayton, Jasmine A.
  • Musa, Mazlina
  • Morris, Russell E.
  • Whittle, Karl
  • Mckay, David
  • Moran, Robert
  • Bignami, Giulia P. M.
  • Blanc, Frédéric
  • Fernandes, Arantxa
  • Sneddon, Scott
  • Tang, Chiu C.
  • Broom, Lucy
  • Clarkson, Guy
  • Hooper, Joseph E.
  • Opanasenko, Maksym
  • Morris, Samuel A.
  • Firth, Daniel S.
  • Čejka, Jiři
  • Slawin, Alexandra Martha Zoya
  • Wheatley, Paul S.
  • Položij, Miroslav
  • Mayoral, Alvaro
  • Nachtigall, Petr
  • Russell, Samantha E.
  • Lawson, Sebastian
  • Whittle, Karl R.
  • Veazey, Richard
  • Warrender, Stewart J.
  • Thompson, Stephen P.
  • Slawin, Alexandra M.
  • Hong, Suk Bong
  • Daturi, Marco
  • Picone, A. Lorena
  • Wright, Paul A.
  • Vimont, Alexandre
  • Gaberova, Lucia
  • Moulin, Beatrice
  • Sung, Sam Kyung
  • Park, Min Bum
  • Nam, In-Sik
  • Llewellyn, Philip L.
OrganizationsLocationPeople

article

17O solid-state NMR spectroscopy of A2B2O7 oxides

  • Whittle, Karl
  • Mckay, David
  • Moran, Robert
  • Bignami, Giulia P. M.
  • Blanc, Frédéric
  • Dawson, Daniel M.
  • Ashbrook, Sharon. E.
  • Fernandes, Arantxa
  • Sneddon, Scott
Abstract

The potential of <sup>17</sup>O NMR spectroscopy for the investigation of A<sub>2</sub>B<sub>2</sub>O<sub>7</sub> ceramic oxides important in the encapsulation of radioactive waste, is demonstrated, with post-synthetic enrichment by exchange with <sup>17</sup>O<sub>2</sub> gas. For Y<sub>2</sub>Sn<sub>2</sub>O<sub>7</sub>, Y<sub>2</sub>Ti<sub>2</sub>O<sub>7</sub> and La<sub>2</sub>Sn<sub>2</sub>O<sub>7</sub> pyrochlores, enrichment of the two distinct O species is clearly non quantitative at lower temperatures (~700 °C and below) and at shorter times, despite these being used in prior work, with preferential enrichment of OA<sub>2</sub>B<sub>2</sub> favoured over that of OA<sub>4</sub>. At higher temperatures, the <sup>17</sup>O NMR spectra suggest that quantitative enrichment has been achieved, but the integrated signal intensities do not reflect the crystallographic 1:6 (O1:O2) ratio until corrected for differences in T<sub>1</sub> relaxation rates and, more importantly, the contribution of the satellite transitions. <sup>17</sup>O NMR spectra of Y<sub>2</sub>Zr<sub>2</sub>O<sub>7</sub> and Y<sub>2</sub>Hf<sub>2</sub>O<sub>7</sub> defect fluorites showed little difference with any variation in enrichment temperature or time, although an increase in the absolute level of enrichment (up to ~7.5%) was observed at higher temperature. DFT calculations show that the six distinct resonances observed cannot be assigned unambiguously, as each has contributions from more than one of the five possible next nearest neighbour environments. For La<sub>2</sub>Ti<sub>2</sub>O<sub>7</sub>, which adopts a layered perovskite-like structure, little difference in the spectral intensities is observed with enrichment time or temperature, although the highest absolute levels of enrichment (~13%) were obtained at higher temperature. This work demonstrates that <sup>17</sup>O NMR has the potential to be a powerful probe of local structure and disorder in oxides, but that considerable care must be taken both in choosing the conditions for <sup>17</sup>O enrichment and the experimental acquisition parameters if the necessary quantitative measurements are to be obtained for more complex systems.

Topics
  • perovskite
  • impedance spectroscopy
  • layered
  • defect
  • density functional theory
  • Nuclear Magnetic Resonance spectroscopy