Simon Blaschke

Master thesis (2020)

under supervision of Dr. S. Stopkowicz

Berechnung der Elektronenstruktur von Atomen und Molekülen in starken Magnetfeldern mittels Cholesky-Zerlegung

 

PhD thesis (since January 2021)

under supervision of Dr. S. Stopkowicz

Effiziente quantenchemische Berechnungen von Atomen und Molekülen in starken Magnetfeldern

 

Publications

    1. Cholesky decomposition of complex two-electron integrals over GIAOs: Efficient MP2 computations for large molecules in strong magnetic fields
      S. Blaschke and S. Stopkowicz*
      J. Chem. Phys., 156, 044115 (2022)
    2. Cholesky Decomposition of Two-Electron Integrals in Quantum-Chemical Calculations with Perturbative or Finite Magnetic Fields using Gauge-Including Atomic Orbitals
      J. Gauss, S. Blaschke, S. Burger, T. Nottoli, F. Lipparini and S. Stopkowicz
      Mol. Phys. 121, e2101562 (2023)
    3. A DZ White Dwarf with a 30 MG Magnetic Field
       M.A. Hollands, S. Stopkowicz, M.-P. Kitsaras, F. Hampe, S. Blaschke, J.J. Hermes
      Mon. Not. R. Astron. Soc.       520, 3560-3575 (2023)