Results 161 to 170 of about 17,786 (291)

A Closed‐Loop Direct Recycling Process for Prussian White From Scrap and End‐of‐Life Sodium‐Ion Batteries

Advanced Energy Materials, EarlyView.
A closed‐loop direct recycling route for Prussian White sodium‐ion battery cathodes is demonstrated. Ice‐stripped scrap and end‐of‐life electrodes are regenerated via low‐temperature aqueous resodiation (80°C), restoring sodium content, Fe2+ redox chemistry, and structural integrity.
Subha Samanta, Bowen Liu, Dongrui Xie, Joel Cornelio, Wilgner Lima da Silva, Manoj Mayaji Ovhal, Anton Zorin, Peter R. Slater, Emma Kendrick   +8 more
wiley   +1 more source

Data‐Driven High‐Throughput Volume Fraction Estimation From X‐Ray Diffraction Patterns

Advanced Intelligent Discovery, EarlyView.
Long exposure times and the need for manual evaluation limit the use of X‐ray diffraction in high‐throughput applications. This study presents a data‐driven approach addressing both issues. HiVE (a method for High‐throughput Volume fraction Estimation) performs composition estimation for high‐noise XRD patterns produced using polychromatic emission ...
Hawo H. Höfer, André Orth, Robert Wang, Ben Breitung, Simon Schweidler, Jasmin Aghassi‐Hagmann, Markus Reischl   +6 more
wiley   +1 more source

Rietveld Refinement of Electron Diffraction Patterns of Nanocrystalline Materials Using MAUD: Two-Beam Dynamical Correction Implementation and Applications. [PDF]

Materials (Basel)
Sinha A, Abram V, Lutterotti L, Gialanella S.   +3 more
europepmc   +1 more source

Hydration Behavior of Tricalcium Silicate in Seawater Relevant Salt Systems: A Hybrid Study with the Aid of Machine Learning

Advanced Intelligent Discovery, EarlyView.
The hydration behavior of C3S in seawater‐relevant solutions is studied based on experiments, boundary nucleation and growth (BNG) modeling, and machine learning. The main ions included in seawater modify hydration mechanisms, with MgCl2 showing the strongest acceleration effect at the same concentration.
Yanjie Sun, Chen Zhang, Ting Zhang, Mengze Hong, Peiliang Shen, Chi Sun Poon, Gang Li   +6 more
wiley   +1 more source

Prediction‐Guided Two‐Step Solid‐State Exploration of Unknown Pseudo‐Ternary Oxides

Advanced Intelligent Discovery, EarlyView.
Prediction‐guided selection combined with two‐step solid‐state exploration enables efficient search of unknown pseudo‐ternary oxides. Broad robotic slurry screening followed by manual single‐phase isolation leads to the discovery of a new oxide, Ba5SnV6O22, showing how data‐guided experiments connect unexplored composition regions to new materials ...
Hiroyuki Hayashi
wiley   +1 more source

Rietveld Refinement Analysis of Lampung Natural Zeolite Catalyst Impregnated Fe with Diffraction Method Using MAUD Software [PDF]

This research characterizes the space group and R-phase crystal structure using the XRD method and Rietveld refinement. Rietveld improvements using the Material Analysis Using Diffraction (MAUD) software are acceptable if the Rwp < 15% and Sig < 2 ...
Adhani, Lisa
core  

Disentangling chemical pressure and superexchange effects in lanthanide-organic valence tautomerism. [PDF]

Chem Sci
Viborg A, Dunstan MA, Yutronkie NJ, Chanda A, Trier F, Pryds N, Wilhelm F, Rogalev A, Pinkowicz D, Pedersen KS.   +9 more
europepmc   +1 more source

Profex: a graphical user interface for the Rietveld refinement program BGMN. [PDF]

J Appl Crystallogr, 2015
Doebelin N, Kleeberg R.
europepmc   +1 more source

Elastic-strain tensor by Rietveld refinement of diffraction measurements

, 1998
A procedure to obtain all components of the elastic-strain tensor by simultaneous Rietveld refinement of diffraction patterns collected at different specimen orientations is described. The refined lattice parameters yield the hydrostatic strain component.
Robert B. Von Dreele, Kristin Bennett, Davor Balzar A, Hassel Ledbetter   +3 more
core  

Navigation through high-dimensional chemical space: discovery of Ba₅Y₁₃[SiO₄]₈O_8.5 and Ba₃Y₂[Si₂O₇]₂. [PDF]

Chem Sci
Gulay NL, Zanella M, Robertson CM, Ritchie D, Sonni M, Wright MA, Newnham JA, Hawkins CJ, Whitworth J, Mali BP, Niu H, Dyer MS, Collins CM, Daniels LM, Claridge JB, Rosseinsky MJ.   +15 more
europepmc   +1 more source