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02671 Data-Driven Methods for Computational Science and Engineering

2023/2024

Course information
Data-Drevne Metoder til computer beregninger indenfor Forskning og Ingeniørvidenskab
English
5
MSc
Autumn E2B (Thurs 8-12)
Campus Lyngby
Lectures and handson exercises distributed equally.
13 weeks
E2B
Evaluation of experiments and reports
Exercises collected in a report and a poster presentation at the end of the course.
All Aid
7 step scale , internal examiner
02601/02450/02631/02635 , The participants are expected to have some basic programming experiences (fx. python) prior to entering the courses. It is an advantage to have knowledge in numerical algorithms and machine learning.
Minimum 10 Maximum: 100
Allan Peter Engsig-Karup , Lyngby Campus, Building 303B, Ph. (+45) 4525 3073 , apek@dtu.dk
01 Department of Applied Mathematics and Computer Science
At the Studyplanner
This course gives the student an opportunity to prepare a project that may participate in DTU's Study Conference on sustainability, climate technology, and the environment (GRØN DYST). More information http://www.groendyst.dtu.dk/english
A EuroTeQ course
General course objectives
This course contributes to establishing a solid knowledge of theory and practice in Scientific Computing, complementing with data-driven techniques the established numerical solution of differential equation systems based on ODEs/SDEs/PDEs. Data-driven discovery is revolutionizing the modeling, prediction, and control of complex systems. This course draws on machine learning, engineering mathematics, and mathematical physics to integrate modeling and control of dynamical systems with modern methods in data science. The course introduce and emphasis fundamental techniques and open source high-performance computing tools and frameworks behind recent advances in scientific computing and the emerging area scientific machine learning that enable data-driven methods to be applied to solve scientific problem in a diverse range of complex systems across science and engineering. The range of topics help gain experience and understanding of state-of-the-art that is useful for advanced studies of mathematical problems arising in science and engineering applications. The course structure is such that theoretical foundations are discussed and examined through hands-on exercises in the first 2/3 part of the course. In the last 1/3 part of the course the participants are to do an assignment problem to go more in depth with one topic or tackling a chosen problem that is to be reported as a poster and presented orally to all participants of the course.
Learning objectives
A student who has met the objectives of the course will be able to:
  • Describe, analyze and apply fundamental principles for problems described by differential equations that can be solved using data-driven techniques.
  • Understand problems and questions addressed by data-driven methods.
  • Understand how methods are used as building blocks to address questions using data-driven methods.
  • Be able to choose a suitable method to skillfully utilize data and/or differential equations depending on problem to be addressed.
  • Implement some of these methods in Matlab / Python / Julia.
  • Skillfully perform numerical experiments to validate implementations and interpret the results.
  • Understand how dimensionality reduction techniques work and how they are suitable to use.
  • Understand how reduced order modeling techniques work and how they can be used to solve differential equations and take into account parametrization.
  • Setup and train neural differential equations and physics-informed neural networks to solve differential equations or incorporate these as scientific knowledge to produce accurate surrogate models.
  • Identify and exploit the properties and structure of scientific knowledge within machine learning applications.
  • Understanding fundamental principles behind selected topics (see Parts I through V below) and demonstrate these in implementations.
  • Independently solve a special topics problem offered in the course and deliver a written presentation of results in a report covering exercises and a poster covering the assignment.
Content
Content (to be selected from parts below and can be matched with participants experiences in the last part of the course, cf. course book )
==============================
PART I : Dimensionality Reduction
Singular Value Decomposition
Fourier and Wavelet Transforms
Sparsity and Compressed Sensing

PART II : Machine Learning and Data Analysis
Regression and Model Selection
Clustering and Classification
Neural Networks and Deep Learning

PART III : Dynamics and Control
Data-Driven Dynamical Systems
Linear Control Theory
Balanced Models for Control
Data-Driven Control

PART IV : Reduced Order Models
Reduced Order Models
Interpolation for Parametric Reduced Order Models

PART V : Scientific Machine Learning (Matlab/​Julia/​PyTorch/​Jax)
High-Performance Computing
Physics-Informed Neural Networks
Universal Differential Equations and Symbolic Regression
Automatic Differentiation and Differentiable Programming
Neural ODEs
Neural Operators

Part VI : Optimisation theory
Introduction to basic optimisation theory

Part VII : Programming
Notebooks, scripts, virtual (reproducible) environments (fx. conda), etc.
Course literature
Book, Brunton & Kutz, “Data-driven Computational Science and Engineering”, https:/​/​www.databookuw.com/​.
Lecture slides with theory and many examples.
Selected research / review papers on selected topics where slides or book is not sufficient.
Last updated
17. marts, 2024