Shern Tee

Lecturer at Griffith University

Queensland, Australia
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Summary

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Shern Tee is a physicist-turned-research-software-engineer and lecturer based in Queensland, Australia, with six years of post-PhD experience developing and implementing molecular dynamics methods. He focuses on constant-potential and nonequilibrium simulations of liquids near conductive surfaces, contributing core C++ implementations to LAMMPS—most notably enhancements to the fix electrode/conp functionality that improved electrochemical and external-field simulations. At Griffith University (and previously as a postdoc at UQ) he blends theoretical method development with production-grade open-source engineering and advocacy for recognition of RSE work. He is active in the RSE Association of Australia and New Zealand and supports the community by answering questions on MatSci forums and StackExchange. Outside research he tinkers with obsolete devices and balances a busy family life with two young children, a detail that underscores his practical, hands-on problem-solving approach.
code6 years of coding experience
job5 years of employment as a software developer
bookAustralian National University
bookDoctor of Philosophy - PhD, Physics, Doctor of Philosophy - PhD, Physics at National University of Singapore
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Github Skills (8)

lammps10
c-language10
molecular-dynamics-simulation10
cprogramming-language10
molecular-simulation10
dynamics10
numerical-methods9
fortran9

Programming languages (7)

C++TypstTeXJavaScriptHTMLJupyter NotebookPython

Github contributions (5)

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lammps/lammps

Dec 2020 - Jan 2023

Public development project of the LAMMPS MD software package
Role in this project:
userBack-end Developer
Contributions:11 reviews, 21 commits, 17 PRs in 2 years 1 month
Contributions summary:Shern contributed significantly to the `fix electrode/conp` functionality within the LAMMPS molecular dynamics package. Their work involved implementing the `compute_array` function and updating the associated documentation. Further modifications focused on improving matrix handling (elastance) and external field interactions, alongside bug fixes related to initialization and output formatting. These changes likely improved the simulation capabilities around electrochemistry and external field applications.
lammpsmolecular-dynamicssimulationkokkos
srtee/lammps-USER-CONP2

Nov 2020 - Jan 2023

updated constant potential plugin for LAMMPS
Contributions:1 release, 1 review, 308 commits in 2 years 2 months
constantupdatedlammpsplugin
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Shern Tee - Lecturer at Griffith University