brucefan1983 / LSQT-JupyterLinks
A tutorial on the linear scaling quantum transport methods using Jupyter (with Python3)
☆14Updated 6 years ago
Alternatives and similar repositories for LSQT-Jupyter
Users that are interested in LSQT-Jupyter are comparing it to the libraries listed below
Sorting:
- A CUDA-implementation of linear-scaling quantum transport methods☆28Updated last year
- Non-equilibrium green's function method☆17Updated 9 years ago
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆23Updated 5 years ago
- A 100-line Matlab code for phonon transport in 1D atomic chain using the NEGF method☆13Updated 6 years ago
- Modified EPW code for first principles calculation of electron transport and thermoelectric property of materials, including electron-pho…☆26Updated 4 years ago
- Post-processing of electron-phonon coupling calculations from Abinit☆16Updated 4 years ago
- A MATlab toolkit for LAttice DYnamics calculations based on empirical potentials☆10Updated 6 years ago
- Construct phonon tight-binding model and calculate its topological properties☆26Updated 5 years ago
- Exchange parameters of Heisenberg model calculation via Green's function approach☆34Updated last year
- A 200-line Matlab implementation of the Atomistic Green's function (AGF) method for phonon transport☆26Updated 5 years ago
- ☆22Updated 6 months ago
- ☆55Updated last year
- Wavelike and Particlelike Phonon Transport (WPPT) Solver☆28Updated 7 months ago
- A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.☆35Updated 3 years ago
- Tight-binding parameter fitting package (TBFIT) for Slater-Koster method☆30Updated 2 years ago
- Tutorials for the sisl-TBtrans-TranSiesta suite☆43Updated 8 months ago
- The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.☆91Updated 3 months ago
- Calculates Projected Phonon Spectral Energy Density (SED) from molecular dynamics atomic velocity data and phonon eigenvectors☆20Updated 5 years ago
- A repository hosting materials used during Wannier-related tutorials and schools☆41Updated last year
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆26Updated last year
- Visualizing lattice vibration information from phonon dispersion to atoms (For GPUMD)☆31Updated last year
- A toolbox for quickly build inputs and analyze results of DFT codes☆43Updated last year
- Julia package to compute trap-assisted electron and hole capture in semiconductors☆56Updated this week
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆58Updated 3 years ago
- Prototype code of the tight-binding hamiltonian construction neural network model. Check the example_basic_method.py to construct a TB mo…☆31Updated 3 years ago
- Implementation for computing nonradiative recombination rates in semiconductors☆48Updated 9 months ago
- Real-time TDDFT for Quantum-Espresso☆24Updated 2 years ago
- Python modules for electron–phonon models☆33Updated last month
- ☆23Updated 6 years ago
- Symmetry analysis and symmetrize in Wannier orbitals☆41Updated last year