adwwy2005's repositories
aachen_introduction_dftk
A short lecture introducing plane-wave DFT methods and DFTK
Language:Jupyter Notebook000
Language:JavaScript000
Language:JavaScript000
geomConvert
A python utility to convert between XYZ and Z-matrix geometries.
Language:PythonMIT000
NEB
nudge elastic band
Language:Python000
STMpw
Implementation of Bardeen and Tersoff-Hamman approximations.
Language:FortranGPL-3.0000