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Eva Zurek

4 results in Authors: Eva Zurek

Theoretical and Computational Chemistry

High-Pressure Electrides: A Quantum Chemical Perspective

Stefano Racioppi, Eva Zurek

Version 2 posted 10 October 2024

352

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1

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Theoretical and Computational Chemistry

Looking at High-Pressure Electrides Through the Lens of Quantum Crystallography: The Case of Simple Cubic Calcium

Stefano Racioppi, Eva Zurek

Version 1 posted 15 November 2024

149

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1

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Inorganic Chemistry

Actinide 5f Occupations: The Case of PuO2

Ashima Bajaj, Harry Ramanantoanina, Bianca Schacherl, Sven Schenk, Tim Prüßmann, Agost Tasi, David Fellhauer, Alaina Thompson, Jeff Terry, Xiaoyu Wang, Eva Zurek, Tonya Vitova, Paul S. Bagus, Jochen Autschbach

Version 1 posted 14 January 2025

278

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Theoretical and Computational Chemistry

Expanding the Valence-Shell Boundaries of Alkali Metals: Activation of Semi-Core Electrons

Stefano Racioppi, Eva Zurek

Version 1 posted 05 August 2024

145

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