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Anion disorder in Ti pyrochlores as a precursor in the transition to fluorite
The aim of this work is to understand the nature of anion disordering in pyrochlore oxides and to establish what, if any, correlations exist between the anion position, disorder... -
Structural changes in LiMO2 anode materials
It was thought that oxides could not intercalate Li below 1.5V vs Li+/Li. We recently studied layered LiVO2, which intercalates Li at around 0.25V to form Li2VO2, making it an... -
Investigation of molecular rotation and disorder in methylamine borane (CH3NH...
We request 3 days on TOSCA to study molecular rotations of NH4+ and BH4- ions and the ionic disorder in ammonium borohydride (rock salt lattice) and its methylated derivative.... -
Structural disorder in Gamma Alumina
Structural disorder in Gamma Alumina -
Nature of structural disorder in proton conducting In-doped BaZrO3
This proposal requests three days on the Polaris diffractometer to investigate the nature of local structure in the well known proton conducting perovskite system... -
Cation site disorder in KTiOPO4 isostructures
KTiOPO4 (KTP) is a well known non-linear optical material. Its crystal structure has highly asymmetric Ti-O bonds, a rigid TiO6-PO4 lattice and K cations trapped in cages. The... -
Li, Fe, Mn, Si, O, C 626
This dataset has no description
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Diffraction Resistance Measurements of a Chalcopyrite
During the course of a PhD project funded by CCLRC's CMPC, we have developed a cell that allows electrical transport property measurements to be made simultaneously with the... -
IINS measurements on the terminating protons of the basic structural units of...
More than 6 million tonnes of carbon black per year are produced worldwide. The major part is used as reinforcing filler material in tyres and mechanical rubber goods. For... -
Ionic disorder studies of lightweight hydrides by VESUVIO
We ask for 8 days on VESUVIO to study the momentum distribution of LiBH4, Li2NH and Li1+xNH2-x as a function of temperature from 10K-653K (depending on sample). Li2NH and... -
Crystal structures of methanol mono-ammoniate (CD3OD.ND3) and methanol hemi-a...
Mixtures of methanol with water and ammonia dominate the chemistry of cometary bodies, leftovers of the building blocks of the outer planets. We have previously determined the... -
Influence of the cation disorder on the magnetic properties of underdoped cup...
We want to isolate the effects of doping, charge localization and local distortion on the transition from insulating antiferromagnet to superconducting metal in YBCO. We choose... -
Copy Of: Copy Of: Structural disorder in Gamma Alumina: Composition 4
Copy Of: Copy Of: Structural disorder in Gamma Alumina: Composition 4 -
Pair distribution function analysis of stacking disorder in ice
Very recently, the metastable cubic ice phase was renamed to stacking-disordered ice (ice Isd) in order to emphasise the fact that this form of ice contains not only cubic... -
Local structural disorder in the ion conducting complex oxide CeNbO4+d
Complex oxides within the family CeNbO4 have been shown by single crystal x-ray studies to have superstructured average structures, but little detail has been obtained about the... -
Experimental and theoretical study of stable and metastable phases in sputter...
The chalcopyrite Cu(In,Ga)S2 has gained renewed interest in recent years due to its potential application in tandem solar cells. In this contribution, a combined theoretical and... -
Multi-technique approach to unravel the (dis)order in amorphous materials
The concept of order in disordered materials is the key to controlling the mechanical, electrical, and chemical properties of amorphous compounds widely exploited in industrial... -
BELLO: A post-processing tool for the local-order analysis of disordered systems
The characterization of the atomic structure of disordered systems, such as amorphous, glasses and (bio)molecule in solution, is a fundamental step for most theoretical... -
Experimental and theoretical study of stable and metastable phases in sputter...
The chalcopyrite Cu(In,Ga)S2 has gained renewed interest in recent years due to its potential application in tandem solar cells. In this contribution, a combined theoretical and...
