Data sets for "Structure of amorphous materials in the NASICON system Na_{1+x}Ti_2Si_xP_{3-x}O_{12}"

Data sets used to prepare Figures 3, 5 and 6 in the Journal of Physics: Condensed Matter article entitled "Structure of amorphous materials in the NASICON system Na_{1+x}Ti_2Si_xP_{3-x}O_{12}". The data sets refer to the glass structure for the compositions x = 0.8 and x = 1.0, as measured using neutron and x-ray diffraction. The diffraction results were combined with those from 29Si, 31P and 23Na solid-state nuclear magnetic resonance experiments to obtain a more complete picture of the atomic structure. NASICON is an acronym for sodium (Na) super-ionic conductor and NASICON materials are of interest as solid electrolytes and electrode materials for electrical storage energy devices. The crystalline phase can be prepared via the glass-ceramic route, leading to basic questions about the structure of the glass and how it evolves during the process of crystallisation.

Subjects:

Energy

Energy Storage

Facility Development

Materials sciences

Materials Characterisation

Tools, technologies and methods

Scattering & Spectroscopy

Cite this dataset as:
Salmon, P., Zeidler, A., 2023. Data sets for "Structure of amorphous materials in the NASICON system Na_{1+x}Ti_2Si_xP_{3-x}O_{12}". Bath: University of Bath Research Data Archive. Available from: https://doi.org/10.15125/BATH-01226.

Export

Data

Fig3_Sofq_NTSP_v2.agr
text/plain (183kB)
Creative Commons: Attribution 4.0

Figure 3 shows the measured (a) neutron and (b) x-ray total structure factors for glassy NTSP with x = 0.8 and x = 1.0.

Fig5_Dofr_fit_NTSP_ND.agr
text/plain (948kB)
Creative Commons: Attribution 4.0

Figure 5 shows the fitted D'(r) functions for glassy NTSP with (a) x = 0.8 and (b) x = 1.0 measured using neutron diffraction.

Fig6_Dofr_fit_NTSP_XRD.agr
text/plain (199kB)
Creative Commons: Attribution 4.0

Figure 6 shows the fitted D'(r) functions for glassy NTSP with (a) x = 0.8 and (b) x = 1.0 measured using x-ray diffraction.

Creators

Philip Salmon
University of Bath

0000-0001-8671-1011

Anita Zeidler
University of Bath

0000-0001-6501-8525

Contributors

University of Bath
Rights Holder

Coverage

Collection date(s):

From 12 September 2019 to 30 November 2022

Documentation

Data collection method:

The data sets were collected using the methods described in the published paper.

Technical details and requirements:

Figures 3, 5 and 6 were prepared using QtGrace (https://sourceforge.net/projects/qtgrace/). The data set corresponding to a plotted curve within an QtGrace file can be identified by clicking on that curve.

Methodology link:

Mendes Da Silva, R., Zeidler, A., Bradtmüller, H., Eckert, H., Fischer, H. E., Benmore, C. J., and Salmon, P. S., 2023. Structure of amorphous materials in the NASICON system Na 1+x Ti2Si x P 3−x O12. Journal of Physics: Condensed Matter, 35(27), 274002. Available from: https://doi.org/10.1088/1361-648x/acc8af.