Browse by Basel Advisors

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Finkler, Jonas Alexander. Machine Learning in Atomistic Simulations: Enabling the Description of Charge Transfer Effects and Sampling Multi Funnel Systems with Global Monte Carlo Moves. 2023, Doctoral Thesis, University of Basel, Faculty of Science.

Schäfer, Frank. Scientific Machine Learning for the Automated Discovery of Quantum Control Schemes and Phase Diagrams. 2022, Doctoral Thesis, University of Basel, Faculty of Science.

Parsaeifard, Behnam. Improving machine learning methods for the calculation of potential energy surfaces. 2021, Doctoral Thesis, University of Basel, Faculty of Science.

Faber, Felix Andreas. Quantum machine learning in chemical space. 2019, Doctoral Thesis, University of Basel, Faculty of Science.

Graužinytė, Miglė. Enhancing materials properties via targeted doping. 2018, Doctoral Thesis, University of Basel, Faculty of Science.

De, Deb Sankar. Structure prediction of nano materials. 2018, Doctoral Thesis, University of Basel, Faculty of Science.

Saha, Santanu. Soft and accurate norm conserving pseudopotentials and their application for structure prediction. 2017, Doctoral Thesis, University of Basel, Faculty of Science.

Schäfer, Bastian. Probing the characteristics of potential energy surfaces. 2015, Doctoral Thesis, University of Basel, Faculty of Science.

Amsler, Maximilian Kei. Crystal structure prediction based on density functional theory. 2014, Doctoral Thesis, University of Basel, Faculty of Science.

Willand, Alexander. Gaussian pseudopotentials with nonlinear core corrections for chemical accuracy. 2013, Doctoral Thesis, University of Basel, Faculty of Science.

Mohr, Stephan. Fast and accurate electronic structure methods : large systems and applications to boron-carbon heterofullerenes. 2013, Doctoral Thesis, University of Basel, Faculty of Science.

Sadeghi, Ali. Multiscale approach for simulations of Kelvin Probe force microscopy with atomic resolution. 2013, Doctoral Thesis, University of Basel, Faculty of Science.

De, Sandip. Structure prediction of clusters based on the exploration & characterization of their energy landscapes. 2012, Doctoral Thesis, University of Basel, Faculty of Science.

Steiner, Pascal. Modulation of contact resonance frequency in friction force microscopy on the atomic scale. 2011, Doctoral Thesis, University of Basel, Faculty of Science.

Ghasemi, Seyed Alireza. Atomistic simulations of atomic force microscopy. 2010, Doctoral Thesis, University of Basel, Faculty of Science.

Roy, Shantanu. A global optimization approach for searching low energy conformations of proteins. 2010, Doctoral Thesis, University of Basel, Faculty of Science.

Hellmann, Waldemar Vladimir. Exploring the Born-Oppenheimer surface of small and medium-sized Si clusters using the dual minima hopping method. 2007, Doctoral Thesis, University of Basel, Faculty of Science.