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@@ -6,8 +6,8 @@ This list is not exhaustive and other topics related to [our research](/research | |
are equally possible. Several of the projects could also be adapted to the Bachelor level. | ||
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If you are interested in doing a project with us, | ||
**email the project proposer**, mentioning your grades in all relevant classes. | ||
Please be aware of the **[general guidelines](/student_projects/guidelines)**. | ||
please make yourself familiar with **[general guidelines](/student_projects/guidelines)** | ||
we follow during the project. | ||
We will in general not accept or decline any project | ||
until six weeks before the semester begins. | ||
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@@ -59,11 +59,10 @@ knowledge of Julia programming is a bonus, but can also be acquired as we go alo | |
interest in learning about the numerical and mathematical underpinnings of | ||
first-principle based materials simulations. | ||
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**Contact:** [Michael F. Herbst](https://people.epfl.ch/michael.herbst) or [Austin Zadoks](mailto:[email protected]) | ||
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[^CDKL2022]: E. Cancès, G. Dusson, G. Kemlin and A. Levitt. SIAM J. Sci. Comp. **44** (2022). ArXiv [2111.01470](https://arxiv.org/abs/2111.01470v2) | ||
[^Aiida]: S. Huber, et al. Scientific Data. **7**, 300 (2020). https://www.aiida.net/ | ||
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## A mathematical look at modelling superconductor candidate materials with Hubbard corrections | ||
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@@ -97,9 +96,6 @@ knowledge of Julia programming is a bonus, but can also be acquired as we go alo | |
interest in learning about the numerical and mathematical underpinnings of | ||
first-principle based materials simulations. | ||
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**Contact:** [Michael F. Herbst](https://people.epfl.ch/michael.herbst), [Iurii Timrov](https://people.epfl.ch/iurii.timrov) | ||
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[^Lk99griffin]: S. M. Griffin. *Origin of correlated isolated flat bands in copper-substituted lead phosphate apatite*. ArXiv [2307.16892](https://arxiv.org/pdf/2307.16892.pdf) | ||
[^Hubbard]: V. I. Anisimov, J. Zaanen and O. K. Andersen. Phys. Rev. B **44**, 943 (1991). DOI [10.1103/physrevb.44.943](http://dx.doi.org/10.1103/physrevb.44.943) | ||
[^SelfConsistentU]: I. Timrov, N. Marzari and M. Cococcion. Phys. Rev. B **98** (2018). DOI [10.1103/physrevb.98.085127](http://dx.doi.org/10.1103/physrevb.98.085127) | ||
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@@ -126,7 +122,7 @@ for high-performance computing; | |
knowledge of Julia programming is a bonus, but can also be acquired as we go along; | ||
interest in learning Julia's hardware abstractions for GPU computing | ||
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**Contact:** [Michael F. Herbst](https://people.epfl.ch/michael.herbst) | ||
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@@ -174,11 +170,13 @@ basic experience with data-driven methods or machine learning; | |
interest in learning about the numerical and mathematical underpinnings of | ||
first-principle based materials simulations. | ||
**Contact:** [Michael F. Herbst](https://people.epfl.ch/michael.herbst) | ||
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[^uncertanties]: A. Fowler, C. Pickard, J. Elliott. J. Phys. Mater. **2**, 034001 (2019) DOI [10.1088/2515-7639/ab0b4a](http://dx.doi.org/10.1088/2515-7639/ab0b4a) | ||
[^e3nn]: M. Geiger and T. Smidt *e3nn: Euclidean Neural Networks*. ArXiv [2207.09453](https://arxiv.org/abs/2207.09453) | ||
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## Mixed-precision approaches in density-functional theory | ||
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@@ -193,7 +191,7 @@ Strong background in numerical linear algebra in particular Krylov methods; | |
considerable programming skills in python or Matlab; | ||
knowledge of Julia programming is a bonus, but can also be acquired as we go along | ||
**Contact:** [Michael F. Herbst](https://people.epfl.ch/michael.herbst) | ||
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@@ -211,5 +209,3 @@ and their respective algorithms. | |
Experience in running first-principle simulations in standard codes | ||
such as VASP, ABINIT, QuantumEspresso; experience with AiiDA or DFTK is a bonus, | ||
but can also be acquired as we go along. | ||
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**Contact:** [Michael F. Herbst](https://people.epfl.ch/michael.herbst) |