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Logo Institut für Physikalische und Theoretische Chemie der TU Braunschweig

Julia Brüggemann

Julia Brüggemann
Julia Brüggemann
Home Office
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julia.brueggemann(at)tu-braunschweig.de
Profile

Address

Gaußstraße 17
38106 Braunschweig
Germany

 


Research

Vibrational Exciton Models for Biomolecules from Quantum Chemistry

 


Curriculum Vitae

  • since 08/2019:  Ph.D. student in the Jacob Group, TU Braunschweig
  • 10/2017 – 07/2019:  Master of Science, Chemistry, TU Braunschweig
  • 10/2014 – 09/2017:  Bachelor of Science, Chemistry, TU Braunschweig

Conferences and Workshops

  • 06/2023:  Mini-Symposium - Current Developments in Vibrational Structure Theory, Hannover
    Talk: Quantum-Chemical Calculations of 2D-IR Spectra
  • 02/2023:  WAMCC – Workshop on Advanced Methods in Computational Chemistry
    Talk: Git and Version Control
    Talk: 2D-IR Spectroscopy
  • 09/2022:  STC – Symposium on Theoretical Chemistry, Heidelberg
    Poster: Quantum-Chemical Calculation of Two-Dimensional Infrared Spectra
  • 03/2022:  WAMCC – Workshop on Advanced Methods in Computational Chemistry
    Talk: How to get 2D IR Spectra from Anharmonic Calculations
    Talk: Agile Work, Scrum, Mattermost
  • 09/2021:  STC – Symposium on Theoretical Chemistry, Würzburg/Online
    Poster: Quantum-Chemical Calculation of Two-Dimensional Infrared Spectra
  • 10/2019:  JCT – Jung Chemiker Tagung, Braunschweig
    Poster: Spin-State Dependence of Exchange-Correlation Holes
  • 09/2019:  STC – Symposium on Theoretical Chemistry, Rostock
    Poster: Spin-State Dependence of Exchange-Correlation Holes
  • 09/2019:  ESQC – European Summer School in Quantum Chemisty, Torre Normanna 
    Poster: Spin-State Dependence of Exchange-Correlation Holes
  • 03/2019:  Coderefinery Workshop, Stockholm
  • 03/2019:  WAMCC – Workshop on Advanced Methods in Computational Chemistry
    Talk: Austausch-Korrelations-Funktionale

Publications

3: Structural Dependence of Extended Amide~III Vibrations in Two-Dimensional Infrared Spectra

2D-IR cross-peaks

Julia Brüggemann, Maria Chekmeneva, Mario Wolter, Christoph R. Jacob

J. Phys. Chem. Lett. 14 (2023), 9257–9264

Online VersionPreprint Version

2: Quantum-chemical calculation of two-dimensional infrared spectra using localized-mode VSCF/VCI

Julia Brüggemann, Mario Wolter, Christoph R. Jacob

J. Chem. Phys. 157 (2022), 244107

Online VersionPreprint Version

1: Spin-State Dependence of Exchange-Correlation Holes

Spin-State Dependence of Exchange-Correlation Holes

Julia Brüggemann, Christoph R. Jacob

Faraday Discuss. 224 (2020), 56–78 

Online Version Preprint Version

Photo credits on this page

Research

Research Groups
Bauerecker Group
Hohm Group 
Jacob Group
Maul Group
Proppe Group
Tschierlei Group 
Walla Group

Associated Groups
Muñoz Group (GRS)

Emeriti
Becker Group
Gericke Group

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Agnes Pockels lab

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Contact

Technische Universität Braunschweig
Institute of Physical und Theoretical Chemistry

Gaußstraße 17
38106 Braunschweig
P. O. Box 3329
38023 Braunschweig
Germany
Phone +49 531 3915325

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