nguyen-group / QE-SSPLinks
This repository contains example codes for the book: Quantum ESPRESSO Course for Solid‑State Physics, Jenny Stanford Publishing, New York, 372 Pages (2022) by N. T. Hung, A. R. T. Nugraha and R. Saito.
☆68Updated 11 months ago
Alternatives and similar repositories for QE-SSP
Users that are interested in QE-SSP are comparing it to the libraries listed below
Sorting:
- a python package for computing magnetic interaction parameters☆84Updated 2 weeks ago
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆71Updated last month
- ☆70Updated last week
- A Python library for electronic structure pre/post-processing☆190Updated this week
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆59Updated 3 years ago
- Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format☆83Updated 5 years ago
- Advanced tool for Wannier interpolation and integration of k-space integrals☆107Updated this week
- The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.☆91Updated last week
- Fermi surface generation, analysis and visualisation.☆95Updated 3 weeks ago
- BandUP: Band Unfolding code for Plane-wave based calculations☆100Updated 4 years ago
- Electronic transport properties from first-principles calculations☆156Updated this week
- Band unfolding for phonons☆57Updated 11 months ago
- A user friendly tools using Monte Carlo simulations for estimation of Curie temperature☆86Updated 5 months ago
- IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…☆119Updated 2 years ago
- ☆57Updated 2 years ago
- Symmetry analysis and symmetrize in Wannier orbitals☆43Updated last year
- A Wannier90 python interface for VASP and PySCF☆40Updated last year
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆81Updated 4 months ago
- Electronic structure Python package for post analysis and large scale tight-binding DFT/NEGF calculations☆214Updated last week
- Visualise lattice vibrations☆101Updated 3 months ago
- Notes and tutorials on Density Functional Theory calculation using Quantum ESPRESSO.☆153Updated last month
- Implementation for computing nonradiative recombination rates in semiconductors☆49Updated 11 months ago
- Modeling and Crystallographic Utilities☆50Updated 2 years ago
- Exchange parameters of Heisenberg model calculation via Green's function approach☆34Updated last year
- A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.☆36Updated 3 years ago
- Effective Mass Calculator for Semiconductors☆110Updated 4 years ago
- An updated version of the VASP2WANNIER90v2 interface☆100Updated 2 years ago
- KPROJ: A Band Unfolding Program☆46Updated 7 months ago
- Modified EPW code for first principles calculation of electron transport and thermoelectric property of materials, including electron-pho…☆27Updated 5 years ago
- Multiple Scattering Theory code for first principles calculations☆68Updated last week