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4 results in Authors: Elisabeth Keller

Theoretical and Computational Chemistry

Small Basis Set Density Functional Theory Method for Cost-efficient, Large-scale Condensed Matter Simulations

Elisabeth Keller, Jack Morgenstein, Karsten Reuter, Johannes T. Margraf

Version 1 posted 20 June 2024

218

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Organic Chemistry

The occurrence of ansamers in the synthesis of cyclic peptides

Guiyang Yao, Simone Kosol, Marius Wenz, Elisabeth Irran, Bettina Keller, Oliver Trapp, Roderich Süssmuth

Version 1 posted 13 June 2022

575

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Theoretical and Computational Chemistry

Regularized Second-Order Correlation Methods for Extended Systems

Elisabeth Keller, Theodoros Tsatsoulis, Karsten Reuter, Johannes T. Margraf

Version 1 posted 24 November 2021

317

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Theoretical and Computational Chemistry

Exploring Atom-Pairwise and Many-Body Dispersion Corrections for the BEEF-vdW Functional

Elisabeth Keller, Volker Blum, Karsten Reuter, Johannes T. Margraf

Version 1 posted 25 November 2024

123

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