Alternatives and similar repositories for q-e_old:

Users that are interested in q-e_old are comparing it to the libraries listed below

• dalcorso / pslibrary
  A library of ultrasoft and PAW pseudopotentials
  ☆77Updated 2 years ago
• yambo-code / yambo
  This is the official GPL repository of the yambo code
  ☆107Updated this week
• RMGDFT / rmgdft
  RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…
  ☆48Updated this week
• vossjo / ase-espresso
  ase interface for Quantum Espresso
  ☆67Updated 5 years ago
• shankar1729 / jdftx
  JDFTx: software for joint density functional theory
  ☆88Updated 2 months ago
• wannier-berri / wannier-berri
  Advanced tool for Wannier interpolation and integration of k-space integrals
  ☆99Updated 2 weeks ago
• molgw / molgw
  Accurate many-body perturbation theory calculations of the electronic structure of molecules and clusters
  ☆42Updated 3 weeks ago
• nakib / elphbolt
  A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.
  ☆48Updated this week
• giovannipizzi / seekpath
  A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
  ☆133Updated last week
• Z2PackDev / TBmodels
  A tool for creating and manipulating tight-binding models.
  ☆38Updated last month
• dceresoli / ce-tddft
  Real-time TDDFT for Quantum-Espresso
  ☆24Updated last year
• pipidog / ONCVPSP
  Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
  ☆80Updated 5 years ago
• mailhexu / TB2J
  a python package for computing magnetic interaction parameters
  ☆76Updated this week
• libmbd / libmbd
  Many-body dispersion library
  ☆54Updated 6 months ago
• OrderN / CONQUEST-release
  Full public release of large scale and linear scaling DFT code CONQUEST
  ☆106Updated 2 weeks ago
• SebWouters / CheMPS2
  CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry
  ☆70Updated 3 years ago
• jjgoings / McMurchie-Davidson
  do a simple closed shell Hartree-Fock using McMurchie-Davidson to compute integrals
  ☆82Updated 10 months ago
• BURAI-team / burai
  BURAI, a GUI system of Quantum ESPRESSO
  ☆63Updated 3 years ago
• UppASD / UppASD
  The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.
  ☆89Updated 2 weeks ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆78Updated last year
• oncvpsp / oncvpsp
  The official repository of the oncvpsp code to generate optimized norm-conserving Vanderbilt pseudopotentials
  ☆19Updated 9 months ago
• Quantum-Dynamics-Hub / libra-code
  ☆52Updated last week
• pekkosk / hotbit
  ASE density-functional tight-binding calculator
  ☆65Updated 2 months ago
• lanl / LATTE
  Developer repository for the LATTE code
  ☆41Updated this week
• exciting / exciting
  The exciting code is a powerful open-source DFT package targeted to scientific developers and users that need a modern and adaptable plat…
  ☆58Updated 2 months ago
• phonopy / phono3py
  A simulation package of phonon-phonon interaction related properties
  ☆136Updated this week
• abinit / abipy
  Open-source library for analyzing the results produced by ABINIT
  ☆120Updated this week
• gVallverdu / bandstructureplots
  Band structure plots using pymatgen and a rgb scale to look at atomic or orbital contributions.
  ☆46Updated 6 years ago
• orex / supercell
  The program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.
  ☆100Updated 8 months ago
• aiidateam / aiida-quantumespresso
  The official AiiDA plugin for Quantum ESPRESSO
  ☆61Updated last week