About Me

I'm a tenure-track scientist at the Laboratory for Simulation and Modelling (LSM) at the Paul Scherrer Insitute (PSI). Before taking up this position at PSI, I was a post-doctoral researcher at the Chair of high performance numerical algorithms and simulations (HPNALGS) at EPFL under the supervision of Laura Grigori. Prior to moving to EPFL, I was a post-doctoral researcher at the Laboratoire Jacques-Louis Lions under the supervision of Yvon Maday. Along with several of Yvon's students and collaborators, I worked on the Extreme-scale Mathematically-based Computational Chemistry ERC Synergy project. Before taking up my post-doctoral position at the LJLL, I studied at RWTH Aachen and ETH Zürich. I wrote my Phd Dissertation under Benjamin Stamm, and before that my MS thesis under Sid Mishra.



Research Interests

The main part of my research involves the numerical analysis of state-of-the-art wave-function methods that are used to solve the electronic Schrödinger equation. My post-doc at EPFL involved the analysis of the DMRG algorithm for computing the ground states of strongly correlated molecules while my post-doc at the LJLL focused on the analysis of coupled cluster methods for computing the ground states of dynamically correlated molecules.

In a joint project with Eric Cancès and some colleagues at CERMICS (Ecole des Ponts), I also work on band structure calculations of crystalline materials. Additionally, together with Jean-Philip Piquemal and my former colleagues at the Laboratoire de Chimie Théorique (Sorbonne Université), I work on adaptive variational quantum eigensolvers.

During my Phd, I mostly worked on the mathematical analysis of boundary integral equations and domain decomposition methods with applications in polarisable electrostatics.

A list of my research publications including preprints can be found here.




News and Updates

May 2024
I was a lecturer at the 6th edition of the GDR NBODY Mini-school on mathematics for theoretical chemistry and physics. The school took place from the 28th to 31st of May 2024 at the Laboratoire Jacques-Louis Lions at Sorbonne Université Paris. More information can be found here.

March 2024
I had the pleasure of hosting a workshop on electronic structure theory for solids in March 2024. More information can be found here.


Muhammad Hassan

Tenure-Track Scientist
Laboratory for Simulation and Modelling
Paul Scherrer Institute (PSI)

Office: OHSA/D06
Phone: +41 76 366 89 21
Email: muhammad.hassan(AT)psi.ch


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