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atomic properties

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3 results in Keywords: atomic properties

Chemical Education

Orbital Shaped Standing Waves Using Chladni Plates

Eric Janusson, Johanne Penafiel, Andrew Macdonald, Shaun MacLean, Irina Paci, J Scott McIndoe

Version 1 posted 13 November 2019

866

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Theoretical and Computational Chemistry

DASH Properties: Estimating Atomic and Molecular Properties from a Dynamic Attention-Based Substructure Hierarchy

Marc T. Lehner, Paul Katzberger, Niels Maeder, Gregory A. Landrum, Sereina Riniker

Version 1 posted 11 June 2024

233

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Theoretical and Computational Chemistry

Evaluating quantum alchemy of atoms with thermodynamic cycles: Beyond ground electronic states

Emily Eikey, Alex Maldonado, Charles Griego, Guido Falk von Rudorff, John Keith

Version 1 posted 23 November 2021

313

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