Publications

Henrik R. Larsson (2023). A Tensor Network View of Multilayer Multiconfiguration Time-Dependent Hartree Methods. Molecular Physics, invited New View article.

Huanchen Zhai, Henrik R. Larsson, Seunghoon Lee, Zhi-Hao Cui, Tianyu Zhu, Chong Sun, Linqing Peng, Ruojing Peng, Ke Liao, Johannes Tölle, Junjie Yang, Shuoxue Li, Garnet Kin-Lic Chan (2023). Block2: A Comprehensive Open Source Framework to Develop and Apply State-of-the-Art DMRG Algorithms in Electronic Structure and Beyond. The Journal of Chemical Physics.

Henrik R. Larsson, Markus Schröder, Richard Beckmann, Fabien Brieuc, Christoph Schran, Dominik Marx, Oriol Vendrell (2022). State-resolved infrared spectrum of the protonated water dimer: Revisiting the characteristic proton transfer doublet peak. Chemical Science.

Henrik R. Larsson, Huanchen Zhai, C. J. Umrigar, Garnet Kin-Lic Chan (2022). The chromium dimer: closing a chapter of quantum chemistry. Journal of the American Chemical Society.

Henrik R. Larsson, Huanchen Zhai, Klaas Gunst, Garnet Kin-Lic Chan (2021). Matrix product states with large sites. Journal of Chemical Theory and Computation.

Henrik R. Larsson, David J. Tannor (2020). Control of concerted back-to-back double ionization dynamics in helium. The Journal of Chemical Physics.

Henrik R. Larsson, Carlos A. Jiménez-Hoyos, Garnet Kin-Lic Chan (2020). Minimal matrix product states and generalizations of mean-field and geminal wavefunctions. Journal of Chemical Theory and Computation.

Henrik R. Larsson (2019). Computing vibrational eigenstates with tree tensor network states (TTNS) [Editor's Pick]. The Journal of Chemical Physics.

Henrik R. Larsson, Jens Riedel, Jie Wei, Friedrich Temps, Bernd Hartke (2018). Resonance dynamics of DCO (X̃ ²A′) simulated with the dynamically pruned discrete variable representation (DP-DVR). The Journal of Chemical Physics.

David J. Tannor, Shai Machnes, Elie Assémat, Henrik R. Larsson (2018). Phase Space vs. Coordinate Space Methods: Prognosis for Large Quantum Calculations. Advances in Chemical Physics.

Doron Azoury, Michael Krüger, Gal Orenstein, Henrik R. Larsson, Sebastian Bauch, Barry D. Bruner, Nirit Dudovich (2017). Self-probing spectroscopy of XUV photo-ionization dynamics in atoms subjected to a strong-field environment. Nature Communications.

Henrik R. Larsson, D. J. Tannor (2017). Dynamical pruning of the multiconfiguration time-dependent Hartree (DP-MCTDH) method: An efficient approach for multidimensional quantum dynamics. The Journal of Chemical Physics.

Henrik R. Larsson (2017). Efficient Approaches to Multidimensional Quantum Dynamics. PhD thesis.

Henrik R. Larsson, B. Hartke, D. J. Tannor (2016). Efficient molecular quantum dynamics in coordinate and phase space using pruned bases. The Journal of Chemical Physics.

S Bauch, Henrik R. Larsson, C Hinz, M Bonitz (2016). The time-dependent generalized active space configuration interaction approach to correlated ionization dynamics of diatomic molecules. Journal of Physics: Conference Series.

Shai Machnes, Elie Assémat, Henrik R. Larsson, David J. Tannor (2016). Quantum Dynamics in Phase Space using Projected von Neumann Bases. The Journal of Physical Chemistry A.

Henrik R. Larsson, S. Bauch, L. K. Sørensen, M. Bonitz (2016). Correlation effects in strong-field ionization of heteronuclear diatomic molecules. Physical Review A.

Henrik R. Larsson (2014). Laser-Induced Correlated Electron Dynamics in Small Molecules. Master’s thesis.

Henrik R. Larsson, Adri C. T. van Duin, Bernd Hartke (2013). Global optimization of parameters in the reactive force field ReaxFF for SiOH. Journal of Computational Chemistry.

Henrik R. Larsson, Bernd Hartke (2013). Fitting reactive force fields using genetic algorithms. Computer Methods in Materials Science.

Henrik R. Larsson (2012). Globale Parameteroptimierung des reaktiven Kraftfeldes ReaxFF mit Hilfe von evolutionären Algorithmen. Bacherlor’s thesis.