Technische Universität Braunschweig
  • Study & Teaching
    • Beginning your Studies
      • Prospective Students
      • Degree Programmes
      • Application
      • Fit4TU
      • Why Braunschweig?
    • During your Studies
      • Fresher's Hub
      • Term Dates
      • Courses
      • Practical Information
      • Beratungsnavi
      • Additional Qualifications
      • Financing and Costs
      • Special Circumstances
      • Notes on the coronavirus
      • Health and Well-being
      • Campus life
    • At the End of your Studies
      • Discontinuation and Credentials Certification
      • After graduation
      • Alumni
    • For Teaching Staff
      • Strategy, Offers and Information
      • Learning Management System Stud.IP
      • Teaching and Media Education
    • Contact
      • Study Service Centre
      • Academic Advice Service
      • Student Office
  • Research
    • Research Profile
      • Core Research Areas
      • Clusters of Excellence
      • Research Projects
      • Research Centres
      • Professors‘ Research Profiles
    • Early Stage Researchers
      • Promotion of early career scientists
      • PhD-Students
      • Postdocs
      • Junior research group leaders
      • Junior Professorship and Tenure-Track
      • Habilitation
      • Service Offers for Scientists
    • Research Data & Transparency
      • Transparency in Research
      • Research Data
      • Open Access Strategy
      • Digital Research Announcement
    • Research Funding
      • Research Funding Network
      • Research funding
    • Contact
      • Research Services
      • Academy for Graduates
  • International
    • International Students
      • Why Braunschweig?
      • Degree seeking students
      • Exchange Studies
      • TU Braunschweig Summer School
      • Refugees
      • International Student Support
    • Going Abroad
      • Internships abroad
      • Teaching and research abroad
      • Working abroad
    • International Scientists
      • International Postdocs and Professors
      • International PhD Scholars
      • Service for host institutes
    • Language and intercultural competence training
      • Learning German
      • Learning Foreign Languages
      • Intercultural Communication
    • International Profile
      • Internationalisation
      • International Cooperation
    • International House
      • About us
      • Contact & Office Hours
      • News and Events
      • Newsletter, Podcast & Videos
      • Job Advertisements
  • TU Braunschweig
    • Our Profile
      • Aims & Values
      • Regulations and Guidelines
      • Alliances & Partners
      • The University Development Initiative 2030
      • Facts & Figures
      • Our History
    • Career
      • Working at TU Braunschweig
      • Vacancies
    • Economy & Business
      • Entrepreneurship
    • General Public
      • Access to the University Library
    • Media Services
      • Communications and Press Service
      • Services for media
      • Film and photo permits
      • Advices for scientists
      • Topics and stories
    • Contact
      • General Contact
      • Getting here
  • Organisation
    • Presidency & Administration
      • Executive Board
      • Designated Offices
      • Administration
      • Committees
    • Faculties
      • Carl-Friedrich-Gauß-Fakultät
      • Faculty of Life Sciences
      • Faculty of Architecture, Civil Engineering and Environmental Sciences
      • Faculty of Mechanical Engineering
      • Faculty of Electrical Engineering, Information Technology, Physics
      • Faculty of Humanities and Education
    • Institutes
      • Institutes from A to Z
    • Facilities
      • University Library
      • Gauß-IT-Zentrum
      • Personnel Development
      • International House
      • The Project House of the TU Braunschweig
      • Sports center
      • Facilities from A to Z
    • Equal Opportunity Office
      • Equal Opportunity Office
      • Family
      • Diversity for Students
  • Search
  • Quicklinks
    • People Search
    • Webmail
    • cloud.TU Braunschweig
    • Messenger
    • Cafeteria
    • Courses
    • Stud.IP
    • Library Catalogue
    • IT Services
    • Information Portal (employees)
    • Link Collection
    • DE
    • EN
Menu
  • Technische Universität Braunschweig
  • Organisation
  • Faculties
  • Faculty of Life Sciences
  • Institutes
  • Physical and Theoretical Chemistry
  • Computational Materials Design
  • Teaching
Logo Institut für Physikalische und Theoretische Chemie der TU Braunschweig
  • Computational Materials Design
    • Team
    • Teaching
    • Research
    • Publications
    • Job offers

Teaching

Lectures winter semester

Artificial Molecular Intelligence 2022/2023 (M.Sc.)

Target group: Master

Module Number: CM-B-4

Language: English

Description: The students have aquired knowledge on modern methods of quantum chemistry. They are familiar with the foundations of important methods and possess an overview of commonly used quantum-chemical methods, their implementation in scientific software, and their use in chemistry. They are able to judge the applicability and the limits of different quantum-chemical methods and to use choose suitable methods for their own research projects, to perform quantum-chemical calculations and to analyse, evaluate, and assess their results.
Course content: Molecular quantum mechanics in a nutshell: Hartree--Fock (HF) theory, post-HF methods, density functional theory; Molecular machine learning in a nutshell: molecular representations, deep learning and kernel methods, generative models, uncertainty quantification, active learning; Applications: structure--property relationships, chemical space exploration, molecular design.

StudIP event number: 1413195

Lectures summer semester

Structure of matter (Aufbau der Materie, PC3) 2023 (B.Sc.)

Target group: Bachelor (semester 4)

Modul number: CHE-PCI-006

Language: German

Course contents: Fundamentals of the behavior of waves and particles, uncertainty relation,
probability amplitudes and wave function, Schrödinger equation, tunnel effect, molecular vibrations, rotation of molecules, hydrogen atom, structure of the periodic table, chemical bonding, spectroscopy.

StudIP event number: 1413006

More information: university calender

Structure of matter (Aufbau der Materie, PC3) 2022 (B.Sc.)

Target group: Bachelor (semester 4)

Modul number: CHE-PCI-006

Language: German

Course contents: Fundamentals of the behavior of waves and particles, uncertainty relation,
probability amplitudes and wave function, Schrödinger equation, tunnel effect, molecular vibrations, rotation of molecules, hydrogen atom, structure of the periodic table, chemical bonding, spectroscopy.

StudIP event number: 1413006

Theses

Bachelor/Master theses

We are always looking for motivated students for bachelor and master theses as well as "hiwi" jobs (payed minijobs in research). Please write to me (j.proppe@tu-braunschweig.de) or contact me after a lecture or other event. We look forward to hearing from you!

Finished theses

  • Bachelor thesis Tim J. Schulze (winter term 2022/2023)
  • Bachleor thesis Kerstin L. Bublitz (summer term 2023)

Student research project (Studienarbeit)

Research projects Bachelor/Master

If you are interested in a student research project (Bachelor or Master), please write to me (j.proppe@tu-braunschweig.de) or contact me after a lecture or other event.

Photo credits on this page

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

Service

Institute
Workshop
School lab (German)
Agnes Pockels laboratory
Laser safety
Emergency numbers

 

Institute

Institute Director
Executive Board
Staff
Institutional Regulations (German)
 

 

Contact

Technische Universität Braunschweig
Institute of Physical und Theoretical Chemistry

Gaußstraße 17
38106 Braunschweig
P. O. Box 3329, 38023 Braunschweig
Germany
Phone +49 (531) 391-7383

Campusplan

© Technische Universität Braunschweig
Imprint Privacy Accessibility

TU Braunschweig uses the software Matomo for anonymised web analysis. The data serve to optimise the web offer.
You can find more information in our data protection declaration.