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Andre Laestadius

Andre Laestadius

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Academic interests: mathematical quantum chemistry

Academic Background: My background is from mathematics and theoretical chemistry. In my master's thesis, I studied mathematical aspects of quantum chemistry, specifically time-dependent current-density-functional-theory (under supervision of Prof. Olav Vahtras). After that, I completed a PhD in applied mathematics with the thesis Foundations of Density Functionals in the Presence of Magnetic Field.

Current research: I am PI of two projects, CCerror (RCN funded) and REGAL (ERC funded).

The ERC funded project REGAL (full title: Regularized density-functional analysis) started Sept. 2022. The aim of this project is to investigate density-functional theory in a lossless (Moreau-Yosida) regularized setting.

Academic Degrees: I hold the following degrees from Royal Institute of Technology, Stockholm, Sweden:
-Master of Science in Biotechnology (September 2008, final grade: 5.0/5.0, Thesis 5.0/5.0)
-Ph.D in applied mathematics (June 2014, supervisor: M. Benedicks, co-supervisors: A. Szepessy and O. Vahtras)

Fagområder

Vitenskapsdisipliner

Anvendt matematikk

Emner

Tetthetsfunksjonal teori

Forskningsgrupper

Publikasjoner og forskningsresultater

Vitenskapelige publikasjoner

Teale, Andrew Michael; Helgaker, Trygve; Savin, Andreas; Adamo, Carlo; Aradi, Balint; Arbuznikov, Alexei V.; Ayers, Paul W.; Baerends, Evert Jan; Barone, Vincenzo; Calaminici, Patrizia; Cances, Eric; Carter, Emily A.; Chattaraj, Pratim Kumar; Chermette, Henry; Ciofini, Ilaria; Crawford, T. Daniel; de Proft, Frank; Dobson, John F.; Draxl, Claudia; Frauenheim, Thomas; Fromager, Emmanuel; Fuentealba, Patricio; Gagliardi, Laura; Galli, Giulia; Gao, Jaili; Geerlings, Paul; Gidopoulos, Nikitas I.; Gill, Peter M. W.; Gori-Giorgi, Paola; Görling, Andreas; Gould, Tim; Grimme, Stefan; Gritsenko, Oleg; Jensen, Hans Jørgen Aagaard; Johnson, Erin R.; Jones, Robert O.; Kaupp, Martin; Köster, Andreas M.; Kronik, Leeor; Krylov, Anna I.; Kvaal, Simen; Laestadius, Andre; Levy, Mel; Lewin, Mathieu; Liu, Shubin; Loos, Pierre-Francois; Maitra, Neepa T.; Neese, Frank; Perdew, John P.; Pernal, Katarzyna; Pernot, Pascal; Piecuch, Piotr; Rebolini, Elisa; Reining, Lucia; Romaniello, Pina; Ruzsinszky, Adrienn; Salahub, Dennis R.; Scheffler, Matthias; Schwerdtfeger, Peter; Staroverov, Viktor N.; Sun, Jianwei; Tellgren, Erik Ingemar; Tozer, David J.; Trickey, Samuel B.; Ullrich, Carsten A.; Vela, Alberto; Vignale, Giovanni; Wesolowski, Tomasz A.; Xu, Xin; Yang, Weitao (2022). DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science. Physical Chemistry, Chemical Physics - PCCP .
http://hdl.handle.net/10852/101103

Laestadius, Andre; Penz, Markus; Tellgren, Erik Ingemar (2021). Revisiting density-functional theory of the total current density. Journal of Physics: Condensed Matter . Vol. 33.
http://hdl.handle.net/10852/92744

Kvaal, Simen; Laestadius, Andre; Tellgren, Erik Ingemar; Helgaker, Trygve (2021). Lower Semicontinuity of the Universal Functional in Paramagnetic Current-Density Functional Theory. The Journal of Physical Chemistry Letters . Vol. 12.
http://hdl.handle.net/10852/92666

Laestadius, Andre; Faulstich, Fabian Maximilian (2020). One-dimensional Lieb–Oxford bounds. Journal of Chemical Physics . Vol. 152.
http://hdl.handle.net/10852/84100

Kvaal, Simen; Laestadius, Andre; Bodenstein, Tilmann (2020). Guaranteed convergence for a class of coupled-cluster methods based on Arponen's extended theory. 12 s. Molecular Physics . Vol. 118.
http://hdl.handle.net/10852/85350

Laestadius, Andre; Benedicks, Michael; Penz, Markus (2020). Unique continuation for the magnetic Schrodinger equation. International Journal of Quantum Chemistry . Vol. 120.
http://hdl.handle.net/10852/83882

Faulstich, Fabian Maximilian; Laestadius, Andre; Legeza, Örs; Schneider, Reinhold; Kvaal, Simen (2019). Analysis of the Tailored Coupled-Cluster Method in Quantum Chemistry. SIAM Journal on Numerical Analysis . Vol. 57.
http://hdl.handle.net/10852/72496

Faulstich, Fabian Maximilian; Máté, Mihály; Laestadius, Andre; Csirik, Mihály András; Veis, Libor; Antalik, Andrej; Brabec, Jiří; Schneider, Reinhold; Pittner, Jiří; Kvaal, Simen; Legeza, Örs (2019). Numerical and Theoretical Aspects of the DMRG-TCC Method Exemplified by the Nitrogen Dimer. Journal of Chemical Theory and Computation . Vol. 15.

Laestadius, Andre; Tellgren, Erik; Penz, Markus; Ruggenthaler, Michael; Kvaal, Simen; Helgaker, Trygve (2019). Kohn–Sham Theory with Paramagnetic Currents: Compatibility and Functional Differentiability. Journal of Chemical Theory and Computation . Vol. 15.

Penz, Markus; Laestadius, Andre; Tellgren, Erik; Ruggenthaler, Michael (2019). Guaranteed Convergence of a Regularized Kohn-Sham Iteration in Finite Dimensions. Physical Review Letters . Vol. 123.
http://hdl.handle.net/10852/72498





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