nakib / elphbolt
A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.
☆47Updated last week
Alternatives and similar repositories for elphbolt:
Users that are interested in elphbolt are comparing it to the libraries listed below
- Modified EPW code for first principles calculation of electron transport and thermoelectric property of materials, including electron-pho…☆26Updated 4 years ago
- Fermi surface generation, analysis and visualisation.☆93Updated 2 weeks ago
- Implementation for computing nonradiative recombination rates in semiconductors☆43Updated 5 months ago
- The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.☆87Updated this week
- Python scripts to manage and postprocess quantum espresso and yambo calculation.☆14Updated this week
- A tool for creating and manipulating tight-binding models.☆37Updated 2 weeks ago
- Advanced tool for Wannier interpolation and integration of k-space integrals☆97Updated last week
- Band unfolding for phonons☆54Updated 4 months ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆78Updated last year
- Massively parallel vibrational mode calculator.☆23Updated 7 months ago
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆57Updated 3 years ago
- VASP subtool to draw Fermi-Surface; creates input file for Xcrysden☆37Updated 2 years ago
- Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format☆78Updated 5 years ago
- A repository hosting materials used during Wannier-related tutorials and schools☆41Updated 9 months ago
- A high-performance framework for solving phonon and electron Boltzmann equations☆96Updated this week
- BandUP: Band Unfolding code for Plane-wave based calculations☆99Updated 3 years ago
- Modeling and Crystallographic Utilities☆50Updated last year
- A Wannier90 python interface for VASP and PySCF☆36Updated last year
- Tutorials for the sisl-TBtrans-TranSiesta suite☆41Updated 4 months ago
- Python modules for electron–phonon models☆29Updated 2 weeks ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆41Updated 10 months ago
- ☆29Updated 8 months ago
- A module for ASE for elastic constants calculation.☆41Updated last month
- AICON2: A program for calculating transport properties quickly and accurately☆15Updated last year
- Tight-binding parameter fitting package (TBFIT) for Slater-Koster method☆28Updated 2 years ago
- Utility to construct and operate on Hamiltonians from the Projections of DFT wave functions on Atomic Orbital bases (PAO)☆22Updated last year
- a python package for computing magnetic interaction parameters☆75Updated 2 weeks ago
- BerkeleyGW python☆31Updated 3 years ago
- The Temperature Dependent Effective Potentials (TDEP) code☆73Updated this week
- ☆18Updated 6 years ago