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content/info.qmd

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There are **no formal prerequisites for this course**. However, an undergraduate level understanding of materials science and basic coding
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skills in Python can be beneficial. Python will be introduced during the first two weeks through an intensive crash course. In addition,
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core atomistic and materials science concepts will be (re)introduced by week 4.<br>
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**No prior experience in machine learning is required.**
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**No prior experience in machine learning (ML) is required.**
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## Course Format
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The course will begin with lectures and **interactive Python demonstrations** during the first two-thirds of the semester, followed by
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student-led presentations of recent papers, **guest lectures by experts**, and final project presentations in the final third of the
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semester. Code, slides, and homework assignments will be shared on GitHub. One group project, one individual project, and a recent
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paper presentation will ensure that students learn state-of-the-art materials informatics skills and can conduct research in this
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new domain independently. The results obtained in the group project are targeted to be **published in a peer-reviewed journal**.
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paper presentation will ensure that students learn state-of-the-art materials informatics skills and can conduct research independently in this
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new domain. The results obtained in the group project are targeted to be **published in a peer-reviewed journal**.
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## Who is this for?
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This course may be of interest to students of **various backgrounds**, for example, for students with a background in
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- engineering/materials/chemistry/physics who have little coding experience but want to learn about how they can use machine learning in materials science \& chemistry.
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- computer science (i.e., experienced with coding) but little to no background in materials who want to learn about how machine learning can be applied in the materials science \& chemistry domain.
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- engineering/materials/chemistry/physics who have little coding experience but want to learn about how they can use ML in materials science \& chemistry.
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- computer science (i.e., experienced with coding) but little to no background in materials who want to learn about how machine ML can be applied in materials science \& chemistry.
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- experimental research in the lab with little coding experience, who want to learn how they can use Python to complement their experimental work.
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## Resources
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Materials Informatics is a new and rapidly evolving field and hence, conventional textbooks are often not
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an ideal place to start. This course will not follow a specific textbook but will rely on prior efforts of
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various aspects of this field (ML, Python, data science, materials science, etc.):
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various aspects of this field (ML, Python, data science, materials science, etc.) and free online resources:
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- *Machine Learning in Materials Science*, Keith T. Butler, Felipe Oviedo and Pieremanuele Canepa, ACS (2022). [Link (free with NEU login)](https://doi.org/10.1021/acsinfocus.7e5033)
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- *Machine Learning Refined*, Jeremy Watt, Reza Borhani, and Aggelos K. Katsaggelos, 2nd Edition (2024). [Link (free)](https://github.com/neonwatty/machine-learning-refined)
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- *Understanding Deep Learning*, Simon J.D. Prince, The MIT Press (2023). [Link (free)](https://udlbook.github.io/udlbook/)
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- *Deep Learning for Molecules and Materials*, White, Andrew D, Living Journal of Computational Molecular Science (2021). [Link (free)](https://dmol.pub)
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- *Deep Learning for Molecules and Materials*, Andrew D. White, Living Journal of Computational Molecular Science (2021). [Link (free)](https://dmol.pub)
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Further detailed resources and readings on Python and ML will be shared alongside the course material.
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index.qmd

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## Course Summary
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Machine Learning (ML) for Materials Science and Discovery is a 4 semester-hour special topics graduate course.
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Machine Learning for Materials Science and Discovery is a 4 semester-hour special topics graduate course.
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It covers the basics of machine learning and data science as it applies to materials science problems. Large
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materials databases, like the Materials Project, are utilized interactively. Common data types originating
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from computational and experimental methods are surveyed. The materials informatics paradigm is introduced

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