Commits

Commits on Mar 7, 2023

Corrected Adam and NAdam implementations
aromanro
committedMar 7, 2023

Commits on Feb 4, 2023

Added some gradient-descent derived methods that are useful in stochastic context (not that useful here, but I had to try them before implementing them in C++)
aromanro
committedFeb 4, 2023

Commits on Jul 29, 2022

Merge pull request #1 from codacy-badger/codacy-badge
aromanro
committedJul 29, 2022
Add Codacy badge
codacy-badger
committedJul 29, 2022

Commits on May 24, 2022

Removed statistics line from config files
Adrian Roman
committedMay 24, 2022
More in config files
Adrian Roman
committedMay 24, 2022
For CodeFactor
Adrian Roman
committedMay 24, 2022
Nothing
Adrian Roman
committedMay 24, 2022
Avoid CodeFactor complaint about defining O. It's like that in the lectures, assignment and in the paper, likewise in the C++ implementation, so it will stay that way. It would also require many ch…
Adrian Roman
committedMay 24, 2022
For CodeFactor
Adrian Roman
committedMay 24, 2022
For CodeFactor
Adrian Roman
committedMay 24, 2022
For CodeFactor
Adrian Roman
committedMay 24, 2022
For CodeFactor
Adrian Roman
committedMay 24, 2022
For CodeFactor
Adrian Roman
committedMay 24, 2022

Commits on May 19, 2022

Added links to viewer
Adrian Roman
committedMay 19, 2022

Commits on Feb 13, 2022

Code quality improvements
Adrian Roman
committedFeb 13, 2022

Commits on Feb 11, 2022

Added CodeFactor badge
Adrian Roman
committedFeb 11, 2022

Commits on Feb 23, 2021

Minor changes. Removed some comments, tried to improve the convergence for Ge atom
aromanro
committedFeb 23, 2021

Commits on Feb 21, 2021

Some slight improvements, located the reason for bad convergence for variable filling (preconditioned methods do not work so well)
aromanro
committedFeb 21, 2021

Commits on Feb 18, 2021

Commits on Feb 17, 2021

Added a function to create indices and some other minor changes. Replaced the Ge pseudopotential with the fourier transformed one from the assignment, to have comparable results (the zero of energy…
aromanro
committedFeb 17, 2021

Commits on Feb 16, 2021

Last assignment (minus the last part with variable fillings)
aromanro
committedFeb 16, 2021
Removed repeated 'in there' from README.md
aromanro
committedFeb 16, 2021

Commits on Feb 15, 2021

Commits on Feb 14, 2021

Better precision for charted states/energies
aromanro
committedFeb 14, 2021
First part of the third assignment added
aromanro
committedFeb 14, 2021

Commits on Feb 12, 2021

getgrad was wrong for dft, now it finds the correct solution
aromanro
committedFeb 12, 2021
Dft from second assignment is implemented, needs to be checked, though.
aromanro
committedFeb 12, 2021

Commits on Feb 11, 2021

Removed a 'transpose' call that does nothing
aromanro
committedFeb 11, 2021
Part of the second assignment
aromanro
committedFeb 11, 2021

Commits on Feb 9, 2021

Added dft notebook and script. Work in progress, now only Poisson eqn but hopefully more will follow
aromanro
committedFeb 9, 2021

Commits on Nov 10, 2020