Pinned Repositories
GoodVibes
Calculate quasi-harmonic free energies from Gaussian output files with temperature and other corrections
practical-programming-in-chemistry-exercises
pyDFTD3
Python version of Grimme's D3-dispersion correction for Gaussian input/output
pyQRC
Quick Reaction Coordinate using Python
v
A simple X11 molecular viewer
pyQRC
Quick Reaction Coordinate using Python
aligfellow's Repositories
aligfellow/GoodVibes
Calculate quasi-harmonic free energies from Gaussian output files with temperature and other corrections
aligfellow/practical-programming-in-chemistry-exercises
aligfellow/pyDFTD3
Python version of Grimme's D3-dispersion correction for Gaussian input/output
aligfellow/pyQRC
Quick Reaction Coordinate using Python
aligfellow/v
A simple X11 molecular viewer