List of works - Christophe Legein

19F High Magnetic Field NMR Study of β-ZrF4and CeF4: From Spectra Reconstruction to Correlation between Fluorine Sites and19F Isotropic Chemical Shifts

scientific article published on 01 December 2006

27Al NMR experiments and quadrupolar parameter ab initio calculations: Crystallographic structure refinement of β-Ba3AlF9

Accurate heteronuclear J-coupling measurements in dilute spin systems using the multiple-quantum filtered J-resolved experiment

scientific article published on 20 April 2007

Advances in Structural Analysis of Fluoroaluminates Using DFT Calculations of27Al Electric Field Gradients

article

Atomic Insights into Nanoparticle Formation of Hydroxyfluorinated Anatase Featuring Titanium Vacancies

scientific article published on 28 June 2016

Ca2+/vacancies and O2−/F−ordering in new oxyfluoride pyrochlores Li2xCa1.5−x□0.5−xM2O6F (M = Nb,Ta) for 0 ≤ x ≤ 0.5

scientific article published on 01 June 2007

Cluster Models and ab Initio Calculations of19F NMR Isotropic Chemical Shifts for Inorganic Fluorides

scientific article published on 01 May 2005

Controlled hydroxy-fluorination reaction of anatase to promote Mg2+ mobility in rechargeable magnesium batteries

article

Correlation between19F Environment and Isotropic Chemical Shift in Barium and Calcium Fluoroaluminates

scientific article published on 01 April 2004

Double-quantum 19F-19F dipolar recoupling at ultra-fast magic angle spinning NMR: application to the assignment of 19F NMR spectra of inorganic fluorides

scientific article published on 23 September 2009

Electric field gradients in fluoride crystalline powders: correlation of NMR measurements with ab initio calculations

scientific article published on 01 June 2004

Fluoride solid electrolytes: investigation of the tysonite-type solid solutions La1-xBaxF3-x (x < 0.15).

scientific article

From crystalline to glassy gallium fluoride materials: an NMR study of and quadrupolar nuclei

article

Hybrid Perovskite Resulting from the Solid-State Reaction between the Organic Cations and Perovskite Layers of α1-(Br-(CH2)2-NH3)2PbI4

article

Insight into the Crystalline Structure of ThF4 with the Combined Use of Neutron Diffraction, 19F Magic-Angle Spinning-NMR, and Density Functional Theory Calculations

scientific article published on 26 November 2018

Insight into the factors influencing NMR parameters in crystalline materials from the KF–YF3 binary system

scientific article published on 01 January 2019

Lithium Intercalation in Anatase Titanium Vacancies and the Role of Local Anionic Environment

scholarly article by Jiwei Ma et al published 7 April 2018 in Chemistry of Materials

Microwave Synthesis of an Aluminum Fluoride Hydrate with Cationic Vacancies: Structure, Thermal Stability, and Acidic Properties

scholarly article by Damien Dambournet et al published 25 November 2008 in Chemistry of Materials

Multinuclear high-resolution NMR study of compounds from the ternary system NaF-CaF2-AlF3: from determination to modeling of NMR parameters

scientific article published on 01 December 2006

NMR Crystallography, Hydrogen Bonding and Optical Properties of the Novel 2D Hybrid Oxyfluorotitanate [H2taz]2·(Ti5O5F12)

scholarly article by Marjorie Albino et al published 9 October 2018 in Crystal Growth & Design

NMR parameters in alkali, alkaline earth and rare earth fluorides from first principle calculations

scientific article published on 22 September 2011

NMR parameters in column 13 metal fluoride compounds (AlF3, GaF3, InF3 and TlF) from first principle calculations

Nanostructured Al-based Fluoride-Oxide Materials with a Core-Shell Morphology

Nanostructured Aluminium Hydroxyfluorides Derived from β-AlF3

Neutron Powder Diffraction, Multinuclear, and Multidimensional NMR Structural Investigation of Pb5Ga3F19

scientific article published on 01 December 2008

New Highly Divided Ce−Ca-Based Oxyfluorides with UV-Shielding Properties: Study of the Ce1-xCaxO2-xand Ce1-xCaxO2-x-y/2FySeries

On the assignment of19F MAS NMR spectra of fluoroaluminates using through-space spectral edition of19F–27Al and19F–19F connectivities

scientific article published on 09 December 2008

PbnI4n+2(2n+2)? ribbons (n = 3, 5) as dimensional reductions of 2D perovskite layers in cystamine cation based hybrids, also incorporating iodine molecules or reversible guest water molecules

scientific article published on 31 January 2007

Preparation-Dependent Composition and O/F Ordering in NbO2F and TaO2F.

scientific article

Probing Short and Medium Range Order in Al-based Fluorides using High Resolution Solid State Nuclear Magnetic Resonance and Parameter Modelling

Properties of amorphous silica generated by the fluoride method

Red-Shifted Absorptions of Cation-Defective and Surface-Functionalized Anatase with Enhanced Photoelectrochemical Properties

scientific article published on 24 June 2019

Reversible magnesium and aluminium ions insertion in cation-deficient anatase TiO2.

scientific article

Solid-State19F MAS NMR Investigation of Fluoride Ion Mobility in Lead Fluorides: Correlation with Anionic Conductivity

article

Structural Investigation of α- and β-Sodium Hexafluoroarsenate, NaAsF6, by Variable Temperature X-ray Powder Diffraction and Multinuclear Solid-State NMR, and DFT Calculations

Structural investigation of α-LaZr2F11 by coupling X-ray powder diffraction, 19F solid state NMR and DFT calculations

Structural investigations and acidic properties of high surface area pyrochlore aluminium hydroxyfluoride

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.

scientific article published on 13 November 2015

Structure determination of Ba5AlF13 by coupling electron, synchrotron and neutron powder diffraction, solid-state NMR and ab initio calculations.

scientific article

Structure determination of beta-Pb2ZnF6 by coupling multinuclear solid state NMR, powder XRD and ab initio calculations

scientific article published on 17 September 2008

The Effects of Various Parameters of the Microwave-Assisted Solvothermal Synthesis on the Specific Surface Area and Catalytic Performance of MgF2 Nanoparticles

scientific article published on 12 August 2020

The key role of the composition and structural features in fluoride ion conductivity in tysonite Ce1-xSrxF3-x solid solutions

scientific article

Topotactic desolvation and condensation reactions of 3D Zn3TiF7(H2O)2(taz)3·S (S = 3H2O or C2H5OH)

scientific article published on 26 November 2020

List of works by Christophe Legein

19F High Magnetic Field NMR Study of β-ZrF4and CeF4: From Spectra Reconstruction to Correlation between Fluorine Sites and19F Isotropic Chemical Shifts

27Al NMR experiments and quadrupolar parameter ab initio calculations: Crystallographic structure refinement of β-Ba3AlF9

Accurate heteronuclear J-coupling measurements in dilute spin systems using the multiple-quantum filtered J-resolved experiment

Advances in Structural Analysis of Fluoroaluminates Using DFT Calculations of27Al Electric Field Gradients

Atomic Insights into Nanoparticle Formation of Hydroxyfluorinated Anatase Featuring Titanium Vacancies

Ca2+/vacancies and O2−/F−ordering in new oxyfluoride pyrochlores Li2xCa1.5−x□0.5−xM2O6F (M = Nb,Ta) for 0 ≤ x ≤ 0.5

Cluster Models and ab Initio Calculations of19F NMR Isotropic Chemical Shifts for Inorganic Fluorides

Controlled hydroxy-fluorination reaction of anatase to promote Mg2+ mobility in rechargeable magnesium batteries

Correlation between19F Environment and Isotropic Chemical Shift in Barium and Calcium Fluoroaluminates

Double-quantum 19F-19F dipolar recoupling at ultra-fast magic angle spinning NMR: application to the assignment of 19F NMR spectra of inorganic fluorides

Electric field gradients in fluoride crystalline powders: correlation of NMR measurements with ab initio calculations

Fluoride solid electrolytes: investigation of the tysonite-type solid solutions La1-xBaxF3-x (x < 0.15).

From crystalline to glassy gallium fluoride materials: an NMR study of and quadrupolar nuclei

Hybrid Perovskite Resulting from the Solid-State Reaction between the Organic Cations and Perovskite Layers of α1-(Br-(CH2)2-NH3)2PbI4

Insight into the Crystalline Structure of ThF4 with the Combined Use of Neutron Diffraction, 19F Magic-Angle Spinning-NMR, and Density Functional Theory Calculations

Insight into the factors influencing NMR parameters in crystalline materials from the KF–YF3 binary system

Lithium Intercalation in Anatase Titanium Vacancies and the Role of Local Anionic Environment

Microwave Synthesis of an Aluminum Fluoride Hydrate with Cationic Vacancies: Structure, Thermal Stability, and Acidic Properties

Multinuclear high-resolution NMR study of compounds from the ternary system NaF-CaF2-AlF3: from determination to modeling of NMR parameters

NMR Crystallography, Hydrogen Bonding and Optical Properties of the Novel 2D Hybrid Oxyfluorotitanate [H2taz]2·(Ti5O5F12)

NMR parameters in alkali, alkaline earth and rare earth fluorides from first principle calculations

NMR parameters in column 13 metal fluoride compounds (AlF3, GaF3, InF3 and TlF) from first principle calculations

Nanostructured Al-based Fluoride-Oxide Materials with a Core-Shell Morphology

Nanostructured Aluminium Hydroxyfluorides Derived from β-AlF3

Neutron Powder Diffraction, Multinuclear, and Multidimensional NMR Structural Investigation of Pb5Ga3F19

New Highly Divided Ce−Ca-Based Oxyfluorides with UV-Shielding Properties: Study of the Ce1-xCaxO2-xand Ce1-xCaxO2-x-y/2FySeries

On the assignment of19F MAS NMR spectra of fluoroaluminates using through-space spectral edition of19F–27Al and19F–19F connectivities

PbnI4n+2(2n+2)? ribbons (n = 3, 5) as dimensional reductions of 2D perovskite layers in cystamine cation based hybrids, also incorporating iodine molecules or reversible guest water molecules

Preparation-Dependent Composition and O/F Ordering in NbO2F and TaO2F.

Probing Short and Medium Range Order in Al-based Fluorides using High Resolution Solid State Nuclear Magnetic Resonance and Parameter Modelling

Properties of amorphous silica generated by the fluoride method

Red-Shifted Absorptions of Cation-Defective and Surface-Functionalized Anatase with Enhanced Photoelectrochemical Properties

Reversible magnesium and aluminium ions insertion in cation-deficient anatase TiO2.

Solid-State19F MAS NMR Investigation of Fluoride Ion Mobility in Lead Fluorides: Correlation with Anionic Conductivity

Structural Investigation of α- and β-Sodium Hexafluoroarsenate, NaAsF6, by Variable Temperature X-ray Powder Diffraction and Multinuclear Solid-State NMR, and DFT Calculations

Structural investigation of α-LaZr2F11 by coupling X-ray powder diffraction, 19F solid state NMR and DFT calculations

Structural investigations and acidic properties of high surface area pyrochlore aluminium hydroxyfluoride

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.

Structure determination of Ba5AlF13 by coupling electron, synchrotron and neutron powder diffraction, solid-state NMR and ab initio calculations.

Structure determination of beta-Pb2ZnF6 by coupling multinuclear solid state NMR, powder XRD and ab initio calculations

The Effects of Various Parameters of the Microwave-Assisted Solvothermal Synthesis on the Specific Surface Area and Catalytic Performance of MgF2 Nanoparticles

The key role of the composition and structural features in fluoride ion conductivity in tysonite Ce1-xSrxF3-x solid solutions

Topotactic desolvation and condensation reactions of 3D Zn3TiF7(H2O)2(taz)3·S (S = 3H2O or C2H5OH)