Machine learning with physics-based descriptors for quantum chemistry


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Author / Producer

Date

2023

Publication Type

Doctoral Thesis

ETH Bibliography

yes

Citations

Altmetric

Data

Publication status

published

Editor

Contributors

Book title

Journal / series

Volume

Pages / Article No.

Publisher

ETH Zurich

Event

Edition / version

Methods

Software

Geographic location

Date collected

Date created

Subject

quantum chemistry; machine learning; chemical reaction network; electronic structure calculations; Gaussian process models

Organisational unit

03736 - Reiher, Markus / Reiher, Markus check_circle

Notes

Funding

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