ebylaska's Stars
ebylaska/PWDFT
Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software
kjappelbaum/gptchem
ebylaska/nwchem-bylaska
NWChem: Open Source High-Performance Computational Chemistry
qcc4cp/qcc
Source code for the book "Quantum Computing for Programmers", Cambridge University Press
ebylaska/TinyArrows
TinyArrows is a tiny version of EMSL Arrows
zadorlab/sella
A Python software package for saddle point optimization and minimization of atomic systems.
leeping/geomeTRIC
Geometry optimization code that includes the TRIC coordinate system
ebylaska/FitSNAP
Software for generating SNAP machine-learning interatomic potentials
xulifan/OpenCLFFTConvolution
FFT based convolution using OpenCL
qir-alliance/qcor
C++ compiler for heterogeneous quantum-classical computing built on Clang and XACC
simondevyoutube/Quick_3D_MMORPG
Absolutely 100% unsupported, and full of infuriating bugs.
simondevyoutube/Quick_3D_RPG
corbanbrook/dsp.js
Digital Signal Processing for Javascript
LLNL/mgmol
MGmol is a scalable O(N) First-Principles Molecular Dynamics code that is capable of performing large-scale electronics structure calculations and molecular dynamics simulations of atomistic systems.
myliang/x-spreadsheet
The project has been migrated to @wolf-table/table https://github.com/wolf-table/table