2
I Use This!
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Analyzed 12 months ago. based on code collected 12 months ago.
Jan 16, 2023 — Jan 16, 2024
Commit Message Contributor Files Modified Lines Added Lines Removed Code Location Date
The code has been changed to use gaussians as projector functions and Ono-Hirose restriction of numerical projector functions has been dropped. More... over 18 years ago
configuration.py renamed to config.py More... over 18 years ago
Spherical harmonics stuff only More... over 18 years ago
The new setup.py More... over 18 years ago
Added files for generation of spherical harmonics More... almost 19 years ago
Gaussian stuff More... almost 19 years ago
EXX and gauss stuff More... almost 19 years ago
Added softgauss flag to netcdf file More... almost 19 years ago
EXX stuff More... almost 19 years ago
Pade bugs ... More... almost 19 years ago
Pade bugs ... More... almost 19 years ago
Added Pade xc functional More... almost 19 years ago
Some changes to get the code run under mpich. New environmental variables GRIDPAW_MPIRUN and GRIDPAW_PYTHON, new command line argument --gridpaw-parallel More... almost 19 years ago
testing ... More... almost 19 years ago
description corrected More... almost 19 years ago
class Gauss added More... almost 19 years ago
Gauss moved to gauss.py More... almost 19 years ago
random_array added More... almost 19 years ago
partest.py renamed to parmigrate.py More... almost 19 years ago
convergeall given to calculate_residuals More... almost 19 years ago
convergeall option for calculate_residuals More... almost 19 years ago
convergeall option for calculate_residuals More... almost 19 years ago
convergeall option added More... almost 19 years ago
convergall option added More... almost 19 years ago
convergall option added More... almost 19 years ago
Calling MPI_init with argc and argv in the gpaw-interpreter More... almost 19 years ago
Print the optical spectrum of an excitation list More... almost 19 years ago
Added a symmetric algorithm for calculating Hartree potentials on radial grids. More... almost 19 years ago
opteron problem More... almost 19 years ago
Fixed lamboot problem More... almost 19 years ago