Dempwolff, Adrian Dr. rer. nat.Universität HeidelbergHeidelberg
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Recent publications in heiBIB 
(In total there are 18 publications catalogued)
- Rehn, Dirk R.: Analytical gradients for electron-attached and ionized states for the algebraic-diagrammatic construction scheme for the electron propagator up to third order / Dirk R. Rehn, Andreas Fink, Adrian L. Dempwolff, Andreas Dreuw, 25 September 2024. - 8 S.
In: The journal of physical chemistry, ISSN 1520-5215. 128(2024), 40, special issue, Seite 8795-8802
DOI: 10.1021/acs.jpca.4c04435
- Leitner, Jonas: Fourth-order algebraic diagrammatic construction for electron detachment and attachment : the IP- and EA-ADC(4) methods / Jonas Leitner, Adrian L. Dempwolff, and Andreas Dreuw, 12 September 2024. - 11 S. : Illustrationen
In: The journal of physical chemistry, ISSN 1520-5215. 128(2024), 36 vom: Sept., Seite 7680-7690
DOI: 10.1021/acs.jpca.4c03037
- Dreuw, Andreas: Algebraic diagrammatic construction schemes employing the intermediate state formalism : theory, capabilities, and interpretation / Andreas Dreuw, Antonia Papapostolou, and Adrian L. Dempwolff, 17 August 2023. - 12 S.
In: The journal of physical chemistry, ISSN 1520-5215. 127(2023), 32 vom: Aug., Seite 6635-6646
DOI: 10.1021/acs.jpca.3c02761
- Leitner, Jonas: The fourth-order algebraic diagrammatic construction scheme for the polarization propagator / J. Leitner, A.L. Dempwolff, A. Dreuw, 8 November 2022. - 15 S.
In: The journal of chemical physics, ISSN 1089-7690. 157(2022), 18, Artikel-ID 184101, Seite 1-15
DOI: 10.1063/5.0123814
- Bauer, Marco: Exploring the accuracy and usefulness of semi-empirically scaled ADC schemes by blending second and third order terms / Marco Bauer, Adrian L. Dempwolff, Dirk R. Rehn, and Andreas Dreuw, 12 April 2022. - 13 S.
In: The journal of chemical physics, ISSN 1089-7690. 156(2022), 14, Artikel-ID 144101, Seite 1-13
DOI: 10.1063/5.0087173
- Hodecker, Manuel: Theoretical analysis and comparison of unitary coupled-cluster and algebraic-diagrammatic construction methods for ionization / Manuel Hodecker, Adrian L. Dempwolff, Jochen Schirmer, and Andreas Dreuw, 16 February 2022. - 17 S.
In: The journal of chemical physics, ISSN 1089-7690. 156(2022), 7, Artikel-ID 074104, Seite 1-17
DOI: 10.1063/5.0070967
- Dempwolff, Adrian: Vertical ionization potential benchmark for unitary coupled-cluster and algebraic-diagrammatic construction methods / Adrian L. Dempwolff, Manuel Hodecker, and Andreas Dreuw, 4 February 2022. - 8 S.
In: The journal of chemical physics, ISSN 1089-7690. 156(2022), 5, Artikel-ID 054114, Seite 1-8
DOI: 10.1063/5.0079047
- Rehn, Dirk R.: Gator : a Python-driven program for spectroscopy simulations using correlated wave functions / Dirk R. Rehn, Zilvinas Rinkevicius, Michael F. Herbst, Xin Li, Maximilian Scheurer, Manuel Brand, Ad… , 2021. - 12 S.
In: Wiley interdisciplinary reviews, ISSN 1759-0884. 11(2021), 6, Artikel-ID e1528, Seite 1-12
DOI: 10.1002/wcms.1528
- Epifanovsky, Evgeny: Software for the frontiers of quantum chemistry : an overview of developments in the Q-Chem 5 package / Evgeny Epifanovsky, Adrian Dempwolff, Dirk R. Rehn, Maximilian Scheurer, Andreas Dreuw [und viele we… , 23 August 2021. - 60 S.
In: The journal of chemical physics, ISSN 1089-7690. 155(2021), 8, Artikel-ID 084801, Seite 1-60
DOI: 10.1063/5.0055522
- Dempwolff, Adrian: CAP/EA-ADC method for metastable anions : computational aspects and application to π* resonances of norbornadiene and 1,4-cyclohexadiene / Adrian L. Dempwolff, Alexandra M. Belogolova, Thomas Sommerfeld, Alexander B. Trofimov and Andreas D… , 2 August 2021. - 13 S.
In: The journal of chemical physics, ISSN 1089-7690. 155(2021), 5, Artikel-ID 054103, Seite 1-13
DOI: 10.1063/5.0057737
