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ESM-RISM

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2 results in Keywords: ESM-RISM

Theoretical and Computational Chemistry

A Comparison of Modern Solvation Models for Oxygen Reduction at the Pt(111) Interface

Tom Demeyere, Chris-Kriton Skylaris

Version 2 posted 16 October 2024

240

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Theoretical and Computational Chemistry

Quantifying Uncertainties in Solvation Procedures for Modeling Aqueous Phase Reaction Mechanisms

alex maldonado, Satoshi Hagiwara, Tae Hoon Choi, Frank Eckert, Kathleen Schwarz, Ravishankar Sundararaman, Minoru Otani, John Keith

Version 1 posted 05 October 2020

705

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