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This repository contains examples of genetic algorithm optimisations using the Organisms program that can be run on Jupyter. This can be run either on your computer or live on the web through Binder
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Mar 26, 2021 - Jupyter Notebook
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May 3, 2020 - Jupyter Notebook
Wrapper around ASE Atoms object following the AtomsBase interface
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Mar 3, 2023 - Julia
University project where a command line software called Ale was developed. Ale runs molecular dynamics simulations, at lowest effort. It was designed to be user friendly with config-files specifying simulations. The simulations can be run on e.g. supercomputers in parallel to achieve high throughput when simulating material properties.
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Jan 13, 2022 - Python
Vortrag: TDD, Clean Code, Software Craftmanship und so’n Zeug
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Jan 14, 2018 - CSS
A simple ASE calculator for psi4
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Jul 23, 2019 - Python
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Oct 22, 2022 - Python
Solid state physics project for DIPC
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Jan 17, 2022 - Jupyter Notebook
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Oct 29, 2018 - HTML
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