Shern Tee

**Summary** When simulating an electrochemical system with a mobile solvent ("group sol") and fixed electrodes, the following combination shows altered dynamics resulting in incorrect physical response to charge electrodes: -...

Suggestion: introduce getcwd and listdir, and remove lesson content about Markdown

5

I have helped in a few courses run based on the Gapminder material, and in common with Issue #528, getting to the correct directory and accessing the files is a...

[UPDATED CHAPTER] - Tools for Collaboration

2

### Title [Tools for Collaboration](https://the-turing-way.netlify.app/collaboration/event-tools) ### Guide Guide for Collaboration ### Draft _No response_ ### Summary of proposed chapter EDIT: After writing the below, I realized that there was already...

See https://matsci.org/t/lammps-gui-test-version-for-macos-windows-and-linux/49921/28 Currently LAMMPS shortcuts on Windows are pointed to the initial working directory `%HOMEDRIVE%%HOMEPATH%\Documents`: https://github.com/lammps/lammps-packages/blob/d55e3f7a27f270ebdfcd169b1579442e717fdd41/mingw-cross/installer/lammps-gui.nsis#L310 This is fragile (for example, my computer has Documents pointing to a network share...

Prior to the commits on 14 June 2022, this fix did not correctly charge particles that were multiply-owned on one processor. It only updated the charge on the first owned...

This fix can crash during initialization if atom IDs are non-contiguous. Specifically, suppose a simulation box originally has N particles, with the electrodes listed as the last particles ID-wise (largest...

### Summary I would love to craft a _course outline_ if I had my dream opportunity of teaching a course based on The Turing Way. A Turing Way course could:...