Alternatives and similar repositories for xconfigure

Users that are interested in xconfigure are comparing it to the libraries listed below

• fspiga / qe-gpu
  GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN
  ☆62Updated 5 years ago
• yambo-code / yambo
  This is the official GPL repository of the yambo code
  ☆111Updated this week
• egplar / vasptest
  A test suite for the VASP electronic structure code
  ☆38Updated 11 years ago
• mstsuite / lsms
  LSMS is a code for scalable first principles calculations of materials using multiple scattering theory.
  ☆28Updated 3 weeks ago
• libnegf / libnegf
  ☆19Updated last month
• molgw / molgw
  Accurate many-body perturbation theory calculations of the electronic structure of molecules and clusters
  ☆42Updated 2 months ago
• 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 3 weeks ago
• QEF / q-e_old
  Official mirror of Quantum ESPRESSO
  ☆48Updated 7 years ago
• lanl / LATTE
  Developer repository for the LATTE code
  ☆45Updated last month
• abinit / pseudo_dojo
  Python framework for generating and validating pseudo potentials
  ☆44Updated last year
• 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…
  ☆60Updated 4 months ago
• ghb24 / NECI_STABLE
  Standalone NECI codebase designed for FCIQMC and other stochastic quantum chemistry methods.
  ☆45Updated last year
• hande-qmc / hande
  Open source stochastic quantum chemistry
  ☆76Updated last month
• dftlibs / xcfun
  XCFun: A library of exchange-correlation functionals with arbitrary-order derivatives
  ☆60Updated 2 years ago
• QWalk / mainline
  The mainline development distribution for QWalk
  ☆35Updated 5 years ago
• LLNL / qball
  Qball (also known as qb@ll) is a first-principles molecular dynamics code that is used to compute the electronic structure of atoms, mole…
  ☆45Updated last year
• scafacos / scafacos
  ScaFaCoS library for Fast Coulomb Solvers
  ☆29Updated 3 months ago
• nomad-coe / greenX
  Library for Green’s function based electronic structure theory calculations
  ☆23Updated 2 weeks ago
• Z2PackDev / TBmodels
  A tool for creating and manipulating tight-binding models.
  ☆39Updated 3 months ago
• OrderN / CONQUEST-release
  Full public release of large scale and linear scaling DFT code CONQUEST
  ☆110Updated 2 months ago
• nakib / elphbolt
  A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.
  ☆51Updated last week
• MRChemSoft / mrchem
  MultiResolution Chemistry
  ☆33Updated 3 weeks ago
• janberges / elphmod
  Python modules for electron–phonon models
  ☆33Updated 2 weeks ago
• votca / xtp
  GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in…
  ☆29Updated 3 years ago
• dceresoli / ce-tddft
  Real-time TDDFT for Quantum-Espresso
  ☆24Updated last year
• pyflosic / pyflosic
  Python-based Fermi-Löwdin orbital self-interaction-correction
  ☆23Updated 2 years ago
• electronic-structure / SIRIUS
  Domain specific library for electronic structure calculations
  ☆144Updated last week
• libmbd / libmbd
  Many-body dispersion library
  ☆54Updated 8 months ago
• BerkeleyGW / BGWpy
  BerkeleyGW python
  ☆31Updated 3 years ago
• shankar1729 / jdftx
  JDFTx: software for joint density functional theory
  ☆90Updated this week