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Physical Chemistry

Working Paper

Many-Body Effects Determine the Local Hydration Structure of Cs+ in Solution

Debbie Zhuang, Marc Riera, Gregory K. Schenter, John Fulton, Paesani Lab

Version 1 posted 26 December 2018

610

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Inorganic Chemistry

Working Paper

Revisiting the Dependence of Cu K-Edge X-Ray Absorption Spectra on Oxidation State and Coordination Environment

Julian Rudolph, Christoph R. Jacob

Version 2 posted 03 July 2018

1,503

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Physical Chemistry

Working Paper

X-ray Absorption Spectral Signature of Quantum Nuclei in Liquid Water

Zhaoru Sun, Lixin Zheng, Mohan Chen, Michael L. Klein, Paesani Lab, Xifan Wu

Version 1 posted 10 May 2018

934

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Theoretical and Computational Chemistry

Working Paper

Probing Chirality across the Electromagnetic Spectrum with the Full Semi-classical Light--Matter Interaction

Martin van Horn, Trond Saue, Nanna List

Version 2 posted 27 October 2021

307

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Theoretical and Computational Chemistry

Working Paper

Accurate, Affordable, and Generalisable Machine Learning Simulations of Transition Metal X-ray Absorption Spectra using the XANESNET Deep Neural Network

Conor Rankine, Thomas Penfold

Version 1 posted 03 February 2022

370

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Materials Science

Working Paper

Photoelectrocatalytic conversion of CO2 by transition metal functionalized diamond nanoparticles under solar illumination

Benjamin Kiendl, Adam Day, Sneha Choudhury, Franziska Buchner, Kaan Atak, Arsene Chemin, Christoph Merschjann, Emina Hadzifejzovic, Tim Claridge, Karin Larsson, Amelie Venerosy, Mailis Lounasvuori, Natalia Zabarska, Boyan Iliev, Thomas Schubert, Hugues Girard, Jean-Charles Arnault, Tristan Petit, John Foord, Anke Krueger

Version 1 posted 29 December 2022

379

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Materials Chemistry

Working Paper

High-entropy oxides in the mullite-type structure

Andrea Kirsch, Espen D. Bøjesen, Niels Lefeld, Rasmus Larsen, Jette K. Mathiesen, Susanne L. Skjærvø, Rebecca K. Pittkowski, Denis Sheptyakov, Kirsten M. Ø. Jensen

Version 1 posted 20 December 2022

268

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Materials Science

Working Paper

Understanding the effects of transition metal intercalation on electronic and electrochemical properties of Ti3C2Tx MXene

Shianlin Wee, Xiliang Lian, Evgeniya Vorobyeva, Akhil Tayal, Vladimir Roddatis, Fabio La Mattina, Dario Gomez Vazquez, Netanel Shpigel, Mathieu Salanne, Maria R. Lukatskaya

Version 1 posted 14 August 2023

484

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Molecular-Orbital Framework of Two-Electron Processes: Application to Auger and Intermolecular Coulomb Decay.

Nayanthara Karippara Jayadev, Wojciech Skomorowski, Anna. I. Krylov

Version 1 posted 18 July 2023

171

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Nanoscience

Working Paper

Nanometric chemical decomposition of infertile Himalayan soils from Uttarakhand

KV Chinmaya, KP Sarbeena, Vinitha Johny, Sumantra Pal, Awnish Kumar, Gowravaram Mohan Rao, Siddharth Ghosh, Moumita Ghosh

Version 2 posted 09 March 2023

134

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26 results in X-ray Spectroscopy in Keywords: X-ray Spectroscopy

Many-Body Effects Determine the Local Hydration Structure of Cs+ in Solution

Revisiting the Dependence of Cu K-Edge X-Ray Absorption Spectra on Oxidation State and Coordination Environment

X-ray Absorption Spectral Signature of Quantum Nuclei in Liquid Water

Probing Chirality across the Electromagnetic Spectrum with the Full Semi-classical Light--Matter Interaction

Accurate, Affordable, and Generalisable Machine Learning Simulations of Transition Metal X-ray Absorption Spectra using the XANESNET Deep Neural Network

Photoelectrocatalytic conversion of CO2 by transition metal functionalized diamond nanoparticles under solar illumination

High-entropy oxides in the mullite-type structure

Understanding the effects of transition metal intercalation on electronic and electrochemical properties of Ti3C2Tx MXene

Molecular-Orbital Framework of Two-Electron Processes: Application to Auger and Intermolecular Coulomb Decay.

Nanometric chemical decomposition of infertile Himalayan soils from Uttarakhand

26 results in Keywords: X-ray Spectroscopy