NMR crystallography
C Martineau, J Senker, F Taulelle - Annual Reports on NMR Spectroscopy, 2014 - Elsevier
During the past decade, NMR crystallography has emerged as a complementary strategy to
the usual diffraction techniques for structure determination. Solid-state NMR (ss-NMR) has …
the usual diffraction techniques for structure determination. Solid-state NMR (ss-NMR) has …
NMR crystallography: Applications to inorganic materials
C Martineau - Solid state nuclear magnetic resonance, 2014 - Elsevier
Current developments of NMR crystallography as well as some recent applications to
diamagnetic inorganic solids are presented. First, we illustrate how solid-state NMR data …
diamagnetic inorganic solids are presented. First, we illustrate how solid-state NMR data …
[HTML][HTML] Giant barocaloric effects in sodium hexafluorophosphate and hexafluoroarsenate
Solid-state refrigeration using barocaloric materials is environmentally friendly and highly
efficient, making it a subject of global interest over the past decade. Here, we report giant …
efficient, making it a subject of global interest over the past decade. Here, we report giant …
[HTML][HTML] Fluoride ion donor ability of binary fluorides towards the Lewis acids AsF5 and SbF5
Z Mazej - Journal of Fluorine Chemistry, 2023 - Elsevier
The ability of binary fluorides (MF x, x= 1-7) to donate fluoride ions to the Lewis acids AsF 5
and SbF 5, ie, the synthesis and characterization of solids with emphasis on structural data …
and SbF 5, ie, the synthesis and characterization of solids with emphasis on structural data …
NMR parameters in column 13 metal fluoride compounds (AlF3, GaF3, InF3 and TlF) from first principle calculations
The relationship between the experimental 19 F isotropic chemical shift and the 19 F
isotropic shielding calculated using the gauge including projector augmented-wave …
isotropic shielding calculated using the gauge including projector augmented-wave …
Structural refinement of the RT LaOF phases by coupling powder X-Ray diffraction, 19 F and 139 La solid state NMR and DFT calculations of the NMR parameters
The structures of the β-and t-LaOF phases have been refined from XRPD patterns. For both
phases, 19F and 139La solid-state NMR spectra recorded at high magnetic fields show the …
phases, 19F and 139La solid-state NMR spectra recorded at high magnetic fields show the …
Preparation-Dependent Composition and O/F Ordering in NbO2F and TaO2F
Through an analysis combining powder XRD, TGA, and 19F and 1H solid-state NMR, it is
confirmed for NbO2F and shown for TaO2F that both contain hydroxyl defects and metal …
confirmed for NbO2F and shown for TaO2F that both contain hydroxyl defects and metal …
Feasibility of arsenic and antimony NMR spectroscopy in solids: An investigation of some group 15 compounds
A Faucher, VV Terskikh, RE Wasylishen - Solid State Nuclear Magnetic …, 2014 - Elsevier
The feasibility of obtaining 75 As and 1 21/123 Sb NMR spectra for solids at high and
moderate magnetic field strengths is explored. Arsenic-75 nuclear quadrupolar coupling …
moderate magnetic field strengths is explored. Arsenic-75 nuclear quadrupolar coupling …
NbF5 and TaF5: Assignment of 19F NMR resonances and chemical bond analysis from GIPAW calculations
The 19 F isotropic chemical shifts (δ iso) of two isomorphic compounds, NbF 5 and TaF 5,
which involve six nonequivalent fluorine sites, have been experimentally determined from …
which involve six nonequivalent fluorine sites, have been experimentally determined from …
Different magnitudes of second-order Jahn-Teller effect in isostructural NaMO2F2 (M= Nb, Ta) oxyfluorides
The structures of the ordered and isotype oxyfluorides NaMO 2 F 2 (M= Nb, Ta) were
thoroughly investigated by combining powder X-Ray Diffraction (PXRD), 19 F and high-field …
thoroughly investigated by combining powder X-Ray Diffraction (PXRD), 19 F and high-field …