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2 results in Keywords: Spins

Theoretical and Computational Chemistry

Detection and correction of delocalization errors for electron- and hole-polarons using density-corrected DFT

Bhaskar Rana, Marc Coons, John Herbert

Version 1 posted 22 April 2022

507

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Theoretical and Computational Chemistry

Overcoming Nuclear Spin Diffusion Barrier in DNP via Electron-Electron Flip-Flop

Venkata SubbaRao Redrouthu, Marwa Mannai, Lina Taha, Waqqas Zia, Sajith V Sadasivan, Ribal Jabbour, Asif Equbal

Version 2 posted 14 August 2024

256

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