• Quantum Espresso

  • Referenced in 43 articles [sw06129]
  • QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. QUANTUM ... ultrasoft, and projector-augmented wave). The acronym ESPRESSO stands for opEn Source Package for Research ... General Public License. QUANTUM ESPRESSO builds upon newly-restructured electronic-structure codes that have been ... effort being devoted to user friendliness. QUANTUM ESPRESSO is evolving towards a distribution of independent...
  • BerkeleyGW

  • Referenced in 7 articles [sw17734]
  • ground-state properties, including PARATEC, PARSEC, Quantum ESPRESSO, SIESTA, and Octopus. The package...
  • APE

  • Referenced in 4 articles [sw26729]
  • particular order): Siesta; Octopus; ABINIT; Quantum-Espresso. APE is written in Fortran and is distributed...
  • PhonTS

  • Referenced in 2 articles [sw20304]
  • first principles electronic structure calculations (VASP, Quantum Espresso). PhonTS is written in Fortran and runs...
  • turboTDDFT

  • Referenced in 2 articles [sw06833]
  • component of Quantum ESPRESSO. As with other components, turboTDDFT is optimized...
  • DP-GEN

  • Referenced in 2 articles [sw36442]
  • these three steps: LAMMPS for exploration, Quantum Espresso, VASP, CP2K, etc. for labeling, and DeePMD...
  • TurboEELS

  • Referenced in 2 articles [sw19956]
  • component of Quantum ESPRESSO. As with other components, turboEELS is optimized...
  • PWscf

  • Referenced in 1 article [sw28340]
  • package, a core component of the Quantum ESPRESSO distribution. PWscf performs many different kinds...
  • ElaStic

  • Referenced in 1 article [sw26131]
  • density-functional codes exciting, Wien2k, and Quantum Espresso for energy and stress calculations...
  • EPW

  • Referenced in 1 article [sw06043]
  • vibrational eigenmodes provided by the Quantum-ESPRESSO package with the maximally localized Wannier functions provided...
  • Critic2

  • Referenced in 0 articles [sw20028]
  • programs including WIEN2k, elk, PI, abinit, Quantum ESPRESSO, VASP, Gaussian, and, in general, any other...
  • LAPACK

  • Referenced in 1642 articles [sw00503]
  • LAPACK is written in Fortran 90 and provides...
  • FFTW

  • Referenced in 499 articles [sw04126]
  • FFTW is a C subroutine library for computing...