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8 results in Authors: Andreas Scheurer

Theoretical and Computational Chemistry

Working Paper

The Local Environment of Iron Determines the Rupture Force of Rubredoxin and Not Hydrogen Bond Networks

Maximilian Scheurer, Andreas Dreuw, Martin Head-Gordon, Tim Stauch

Version 1 posted 20 April 2020

504

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Theoretical and Computational Chemistry

Working Paper

Complex Excited State Polarizabilities in the ADC/ISR Framework

Maximilian Scheurer, Thomas Fransson, Patrick Norman, Andreas Dreuw, Dirk R. Rehn

Version 2 posted 14 May 2020

539

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Theoretical and Computational Chemistry

Working Paper

Modeling Molecules Under Pressure with Gaussian Potentials

Maximilian Scheurer, Andreas Dreuw, Evgeny Epifanovsky, Martin Head-Gordon, Tim Stauch

Version 1 posted 23 November 2020

578

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Physical Chemistry

Working Paper

Efficient Open-Source Implementations of Linear-Scaling Polarizable Embedding: Use Octrees to Save the Trees

Maximilian Scheurer, Peter Reinholdt, Jógvan Magnus Haugaard Olsen, Andreas Dreuw, Jacob Kongsted

Version 1 posted 05 March 2021

526

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Theoretical and Computational Chemistry

Working Paper

CPPE: An Open-Source C++ and Python Library for Polarizable Embedding

Maximilian Scheurer, Peter Reinholdt, Erik Kjellgren, Jógvan Magnus Haugaard Olsen, Andreas Dreuw, Jacob Kongsted

Version 1 posted 30 July 2019

732

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Inorganic Chemistry

Working Paper

Low-Spin to Low-Spin Valence Tautomeric Transition in Cobalt Dioxolenes

Max Mörtel, Johannes Oschwald, Andreas Scheurer, Thomas Drewello, Marat Khusniyarov

Version 1 posted 10 April 2023

192

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Citations

Theoretical and Computational Chemistry

Working Paper

Solving Response Expressions in the ADC/ISR Framework

Maximilian Scheurer, Antonia Papapostolou, Thomas Fransson, Patrick Norman, Andreas Dreuw, Dirk Rehn

Version 1 posted 23 December 2022

151

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Nanoscience

Working Paper

SAXS/PCS study on the mesoscopic structure of lipid nanoparticle (LNP) formulations for mRNA drug delivery: Comirnaty and drug-free LNP dispersions

Tobias Unruh, Klaus Götz, Carola Vogel, Erik Fröhlich, Andreas Scheurer

Version 1 posted 21 August 2023

428

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8 results in Andreas Scheurer in Authors: Andreas Scheurer

The Local Environment of Iron Determines the Rupture Force of Rubredoxin and Not Hydrogen Bond Networks

Complex Excited State Polarizabilities in the ADC/ISR Framework

Modeling Molecules Under Pressure with Gaussian Potentials

Efficient Open-Source Implementations of Linear-Scaling Polarizable Embedding: Use Octrees to Save the Trees

CPPE: An Open-Source C++ and Python Library for Polarizable Embedding

Low-Spin to Low-Spin Valence Tautomeric Transition in Cobalt Dioxolenes

Solving Response Expressions in the ADC/ISR Framework

SAXS/PCS study on the mesoscopic structure of lipid nanoparticle (LNP) formulations for mRNA drug delivery: Comirnaty and drug-free LNP dispersions

8 results in Authors: Andreas Scheurer