| 1 |
Characterizing Oxygen Local Environments in Paramagnetic Battery Materials via O-17 NMR and DFT Calculations
Seymour ID, Middlemiss DS, Halat DM, Trease NM, Pell AJ, Grey CP
Journal of the American Chemical Society, 138(30), 9405, 2016 |
| 2 |
Probing Oxide-Ion Mobility in the Mixed Ionic-Electronic Conductor La2NiO4+delta by Solid-State O-17 MAS NMR Spectroscopy
Halat DM, Dervisoglu R, Kim G, Dunstan MT, Blanc F, Middlemiss DS, Grey CP
Journal of the American Chemical Society, 138(36), 11958, 2016 |
| 3 |
Structural Modulation in the High Capacity Battery Cathode Material LiFeBO3
Janssen Y, Middlemiss DS, Bo SH, Grey CP, Khalifah PG
Journal of the American Chemical Society, 134(30), 12516, 2012 |
| 4 |
Probing Cation and Vacancy Ordering in the Dry and Hydrated Yttrium-Substituted BaSnO3 Perovskite by NMR Spectroscopy and First Principles Calculations: Implications for Proton Mobility
Buannic L, Blanc F, Middlemiss DS, Grey CP
Journal of the American Chemical Society, 134(35), 14483, 2012 |
| 5 |
Spin-Transfer Pathways in Paramagnetic Lithium Transition-Metal Phosphates from Combined Broadband Isotropic Solid-State MAS NMR Spectroscopy and DFT Calculations
Clement RJ, Pell AJ, Middlemiss DS, Strobridge FC, Miller JK, Whittingham MS, Emsley L, Grey CP, Pintacuda G
Journal of the American Chemical Society, 134(41), 17178, 2012 |
| 6 |
Defects in Doped LaGaO3 Anionic Conductors: Linking NMR Spectral Features, Local Environments, and Defect Thermodynamics
Blanc F, Middlemiss DS, Gan ZH, Grey CP
Journal of the American Chemical Society, 133(44), 17662, 2011 |
| 7 |
Investigation of Surface Structures by Powder Diffraction: A Differential Pair Distribution Function Study on Arsenate Sorption on Ferrihydrite
Harrington R, Hausner DB, Bhandari N, Strongin DR, Chapman KW, Chupas PJ, Middlemiss DS, Grey CP, Parise JB
Inorganic Chemistry, 49(1), 325, 2010 |
| 8 |
Linking Local Environments and Hyperfine Shifts: A Combined Experimental and Theoretical P-31 and Li-7 Solid-State NMR Study of Paramagnetic Fe(III) Phosphates
Kim J, Middlemiss DS, Chernova NA, Zhu BYX, Masquelier C, Grey CP
Journal of the American Chemical Society, 132(47), 16825, 2010 |
| 9 |
A New Polymorph of N,N'-Dimethylurea Characterized by X-ray Diffraction and First-Principles Lattice Dynamics Calculations
Martins DMS, Spanswick CK, Middlemiss DS, Abbas N, Pulham CR, Morrison CA
Journal of Physical Chemistry A, 113(20), 5998, 2009 |
| 10 |
Experimental and Theoretical Charge Density Study of Polymorphic Isonicotinamide-Oxalic Acid Molecular Complexes with Strong O center dot center dot center dot H center dot center dot center dot N Hydrogen Bonds
Schmidtmann M, Farrugia LJ, Middlemiss DS, Gutmann MJ, McIntyre GJ, Wilson CC
Journal of Physical Chemistry A, 113(50), 13985, 2009 |
