Results 31 to 40 of about 45,221 (235)

Combining EXAFS and Computer Simulations to Refine the Structural Description of Actinyls in Water

open access: yesMolecules, 2020
EXAFS spectroscopy is one of the most used techniques to solve the structure of actinoid solutions. In this work a systematic analysis of the EXAFS spectra of four actinyl cations, [UO2]2+, [NpO2]2+, [NpO2]+ and [PuO2]2+ has been carried out by comparing
Sergio Pérez-Conesa   +3 more
doaj   +1 more source

An in situ XAS study of the cobalt rhenium catalyst for ammonia synthesis [PDF]

open access: yes, 2018
A cobalt rhenium catalyst active for ammonia synthesis at 400 °C and ambient pressure was studied using in situ XAS to elucidate the reducibility and local environment of the two metals during reaction conditions.
Granlund Kirste, Karsten   +6 more
core   +3 more sources

Theoretical investigation of thermal disorder in CuCo alloys

open access: yesResults in Physics, 2020
In this work, we investigate thermal disorder in intermetallic CuCo alloys by extending the anharmonic correlated Einstein model in extended X-ray absorption fine structure (EXAFS) theory.
Pham Thi Minh Hanh   +4 more
doaj   +1 more source

EXAFS Study on Local Structure of Iron Crystal by the Use of Asymmetrical Monochromator and PSPC [PDF]

open access: yes, 1982
The EXAFS spectroscopy equipment constructed from an asymmetrical cut flat monochromator and PSPC is applied to the structural determination of pure α-iron which has small difference (0.038nm) in the first and second nearest neighbour distance.
Hida, M.   +4 more
core   +1 more source

Quantitative analysis of EXAFS data sets using deep reinforcement learning

open access: yesScientific Reports
Extended X-ray absorption fine structure (EXAFS) serves as a unique tool for accurately characterizing the local structural properties surrounding specific atoms. However, the quantitative analysis of EXAFS data demands significant effort.
Eun-Suk Jeong   +2 more
doaj   +1 more source

Biomass Native Structure Into Functional Carbon‐Based Catalysts for Fenton‐Like Reactions

open access: yesAdvanced Functional Materials, EarlyView.
This study indicates that eight biomasses with 2D flaky and 1D acicular structures influence surface O types, morphology, defects, N doping, sp2 C, and Co nanoparticles loading in three series of carbon, N‐doped carbon, and cobalt/graphitic carbon. This work identifies how these structural factors impact catalytic pathways, enhancing selective electron
Wenjie Tian   +7 more
wiley   +1 more source

Local structure of REFeAsO (RE=La, Pr, Nd, Sm) oxypnictides studied by Fe K-edge EXAFS

open access: yes, 2009
Local structure of REOFeAs (RE=La, Pr, Nd, Sm) system has been studied as a function of chemical pressure varied due to different rare-earth size. Fe K-edge extended X-ray absorption fine structure (EXAFS) measurements in the fluorescence mode has ...
A. BIANCONI   +8 more
core   +1 more source

Electroactive Metal–Organic Frameworks for Electrocatalysis

open access: yesAdvanced Functional Materials, EarlyView.
Electrocatalysis is crucial in sustainable energy conversion as it enables efficient chemical transformations. The review discusses how metal–organic frameworks can revolutionize this field by offering tailorable structures and active site tunability, enabling efficient and selective electrocatalytic processes.
Irena Senkovska   +7 more
wiley   +1 more source

Open-source electrochemical cell for in situ X-ray absorption spectroscopy in transmission and fluorescence modes

open access: yesJournal of Synchrotron Radiation
X-ray spectroscopy is a valuable technique for the study of many materials systems. Characterizing reactions in situ and operando can reveal complex reaction kinetics, which is crucial to understanding active site composition and reaction mechanisms.
Hiram Lopez-Astacio   +4 more
doaj   +1 more source

Unveiling the local structure of the amorphous metal $$\text {Fe}_{(1-x)}\text {Zr}_x$$ Fe ( 1 - x ) Zr x combining first-principles-based simulations and modelling of EXAFS spectra

open access: yesScientific Reports, 2023
Amorphous alloys exhibit useful properties such as the excellent soft magnetic behaviour of Fe-based metallic glasses. The detailed structure of amorphous $$\text {Fe}_{(1-x)}\text {Zr}_x$$ Fe ( 1 - x ) Zr x with x = 0.07, 0.10, and 0.20 is in this work ...
Giuseppe Muscas   +7 more
doaj   +1 more source

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