Adrian L. Dempwolff

Germany

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Articles (11)

Year:

2023

Year:

2022

Year:

2022

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2022

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2022

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2021

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2021

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2021

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2021

Year:

2021

Year:

2020

Collaborators (10)

Tomasz Wesolowski

Associate Professor

University of Geneva

SWITZERLAND

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Roberto Peverati

Assistant Professor

Florida Institute of Technology

UNITED STATES

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Josefine Hvarregaard Andersen

KTH Royal Institute of Technology

SWEDEN

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Xing Zhang

California Institute of Technology

UNITED STATES

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Lyudmila V Slipchenko

Professor

Purdue University

UNITED STATES

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Shervin Fatehi

Assistant Professor of Chemistry

The University of Texas Rio Grande Valley

UNITED STATES

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Peter M. W. Gill

AUSTRALIA

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Gergely Gidofalvi

Associate Professor

Gonzaga University

UNITED STATES

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Christopher J. Stein

Technical University of Munich

GERMANY

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Marc de Wergifosse

BELGIUM

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Adrian L. Dempwolff

Research Interests

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Articles (11)

Algebraic Diagrammatic Construction Schemes Employing the Intermediate State Formalism: Theory, Capabilities, and Interpretation

The fourth-order algebraic diagrammatic construction scheme for the polarization propagator

Exploring the accuracy and usefulness of semi-empirically scaled ADC schemes by blending second and third order terms

Theoretical analysis and comparison of unitary coupled-cluster and algebraic-diagrammatic construction methods for ionization

Vertical ionization potential benchmark for unitary coupled-cluster and algebraic-diagrammatic construction methods

Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package

CAP/EA-ADC method for metastable anions: Computational aspects and application to π* resonances of norbornadiene and 1,4-cyclohexadiene

Gator: A Python-driven program for spectroscopy simulations using correlated wave functions

Intermediate state representation approach to physical properties of molecular electron-attached states: Theory, implementation, and benchmarking

A complex absorbing potential electron propagator approach to resonance states of metastable anions

Probing competing relaxation pathways in malonaldehyde with transient X-ray absorption spectroscopy

Collaborators (10)

Tomasz Wesolowski

Roberto Peverati

Josefine Hvarregaard Andersen

Xing Zhang

Lyudmila V Slipchenko

Shervin Fatehi

Peter M. W. Gill

Gergely Gidofalvi

Christopher J. Stein

Marc de Wergifosse

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