Pinned Repositories
ase_gpaw_tools
awesome-rust
A curated list of Rust code and resources.
bgw_qe_tools
Python3 scripts based on ASE for processing input and output files for QuantumEspresso and BerckleyGW
Continued-fraction-representation
Efficient method of integration for the product of a Green's function and the Fermi-Dirac distribution using the continued fraction representation proposed by Ozaki [T. Ozaki, Phys. Rev. B, 75, 035123 (2007)].
FT
Fourier transform
NanoNet
The project represents an extendable Python framework for the electronic structure computations based on the tight-binding method and transport modeling based on the non-equilibrium Green's function (NEGF) method. The code can deal with both finite and periodic system translated in one, two or three dimensions.
negf
The project represents a Python framework for computing the electron transport characteristics using the non-equilibrium Green's function formalism.
P2_bulk
pySBE
Solver for the Semiconductor Bloch Equations describing optical response of a semiconductor nano-structure on an optical excitation.
SBE_cpp
The project is for solving Semiconductor Bloch Equation (SBE) [1] for III-V semiconductor quantum well.
freude's Repositories
freude/NanoNet
The project represents an extendable Python framework for the electronic structure computations based on the tight-binding method and transport modeling based on the non-equilibrium Green's function (NEGF) method. The code can deal with both finite and periodic system translated in one, two or three dimensions.
freude/negf
The project represents a Python framework for computing the electron transport characteristics using the non-equilibrium Green's function formalism.
freude/pySBE
Solver for the Semiconductor Bloch Equations describing optical response of a semiconductor nano-structure on an optical excitation.
freude/bgw_qe_tools
Python3 scripts based on ASE for processing input and output files for QuantumEspresso and BerckleyGW
freude/SBE_cpp
The project is for solving Semiconductor Bloch Equation (SBE) [1] for III-V semiconductor quantum well.
freude/ase_gpaw_tools
freude/Continued-fraction-representation
Efficient method of integration for the product of a Green's function and the Fermi-Dirac distribution using the continued fraction representation proposed by Ozaki [T. Ozaki, Phys. Rev. B, 75, 035123 (2007)].
freude/pyprojwfc
Python script to generate the input file for the script projwfc.x from Quantum Espresso
freude/Atomic-Structure-Tools
freude/badges
:flower_playing_cards: Readme Badges – Gotta catch 'em all
freude/band_bending
freude/chart-csv
Chart a comma separated list of numbers on a line-graph that can be viewed in a web browser
freude/chemcoord
A python module for manipulating cartesian and internal coordinates.
freude/dftbplus
DFTB+ general package for performing fast atomistic simulations
freude/example-python
Python coverage example
freude/file_proessing
freude/freude.github.io
freude/gauss_fit
freude/joomla-papers
ORCiD feed to papers feed for Joomla
freude/Machine-learning-for-photovoltaic-material-property-prediction
Multi-layer perceptron model for photo-voltaic material properties prediction.
freude/matplotlib_for_papers
Handout for the tutorial "Creating publication-quality figures with matplotlib"
freude/nanochain
freude/p_dopant
freude/qe_microtools
freude/quant_arch.github.io
freude/rebound
Command-line tool that instantly fetches Stack Overflow results when you get a compiler error
freude/scivis
freude/sisl
Scientific Python toolbox for large scale tight-binding and electronic structure transport calculations (NEGF)
freude/state-of-the-art-result-for-machine-learning-problems
This repository provides state of the art (SoTA) results for all machine learning problems. We do our best to keep this repository up to date. If you do find a problem's SoTA result is out of date or missing, please raise this as an issue or submit Google form (with this information: research paper name, dataset, metric, source code and year). We will fix it immediately.
freude/wannier_tools
WannierTools: An open-source software package for novel topological materials. Full documentation: