Back
Semester | spring semester 2017 |
Course frequency | Irregular |
Lecturers | Anatole von Lilienfeld (anatole.vonlilienfeld@unibas.ch, Assessor) |
Content | Inverse Question Computing properties: Quantum & Statistical Mechanics/Accuracy vs Cost Chemical Compound Space Perturbation theory and machine learning Optimization (Stochastic, Evolutionary, Gradient, Discrete) High-Performance Computing Examples of compound design |
Learning objectives | Students will become familiar with the state of the art in computational materials and molecular design |
Bibliography | In Mathematical Physics Studies (Springer) volume IX, page 417, (2014) 'Many-Electron Approaches in Physics, Chemistry and Mathematics: A Multidisciplinary View' edited by Luigi Delle Site (FU Berlin) and Volker Bach (TU Braunschweig): Chapter ``Towards the Computational Design of Compounds from First Principles' by von Lilienfeld. Also available online at http://www.chemie.unibas.ch/~anatole/pubs/SpringerChapter2013.pdf |
Admission requirements | Attend minimal number of lectures |
Course application | Belegen via MOnA. |
Language of instruction | English |
Use of digital media | No specific media used |
Interval | Weekday | Time | Room |
---|
No dates available. Please contact the lecturer.
Modules |
Doctorate Chemistry: Recommendations (PhD subject: Chemistry) Module Specialisation (Master Chemistry) Module Specialisation: Chemistry (Master Nanosciences) |
Assessment format | continuous assessment |
Assessment details | Written exam |
Assessment registration/deregistration | Reg.: course registration, dereg: cancel course registration |
Repeat examination | no repeat examination |
Scale | 1-6 0,5 |
Repeated registration | as often as necessary |
Responsible faculty | Faculty of Science, studiendekanat-philnat@unibas.ch |
Offered by | Departement Chemie |