Quantum Espresso
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Cited in
(only showing first 100 items - show all)- grasp2k
- PySCF-NAO
- sim-trhepd-rheed
- sxrdcalc
- Tomli
- testcode.py
- ComDMFT
- WannSymm
- symWannier
- DCore
- DSQSS
- TeNeS
- 2DMAT
- BSA
- PHYSBO
- EasyBuild
- Marlin Firmware
- DFTK
- Wannier90
- Plato
- GULP
- CONQUEST
- GAMESS
- ONETEP
- BLOPEX
- FEAST
- Stability and high-temperature superconductivity in hydrogenated chlorine
- PROFESS
- WIEN2k
- A block Lanczos method for the linear response eigenvalue problem
- HYBRJ
- SIESTA
- LAMMPS
- EPW
- ABINIT
- GAUSSIAN
- NWChem
- GPAW
- KSSOLV
- turboTDDFT
- Libxc
- \textsc{Gibbs2}: A new version of the quasi-harmonic model code. I. Robust treatment of the static data
- \texttt{turboTDDFT} -- a code for the simulation of molecular spectra using the Liouville-Lanczos approach to time-dependent density-functional perturbation theory
- Molecubes
- MOPAC
- GAMESS-UK
- Discrete kernel functions for fcc crystals within Eringen's nonlocal theory of elasticity
- MathLibre
- OCTOPUS
- OpenMx
- DFTB+
- Dftatom
- Runwien
- Gibbs2
- ALPS
- PHON
- Kubo-Greenwood electrical conductivity formulation and implementation for projector augmented wave datasets
- Treecode-accelerated Green iteration for Kohn-Sham density functional theory
- Density functional theory method for twisted geometries with application to torsional deformations in group-IV nanotubes
- BigDFT
- CIF2Cell
- Delocalized nonlinear vibrational modes in fcc metals
- Gibbs2: A new version of the quasiharmonic model code. II. Models for solid-state thermodynamics, features and implementation
- FFTPACK
- XCrySDen
- FreeON
- Lightspeed
- OpenUH
- TraceMIN
- EasyMesh
- S/PHI/nX
- Nanos++
- TASCEL
- spammpack
- CU2CL
- Variationally consistent Hellmann-Feynman forces in the finite element formulation of Kohn-Sham density functional theory
- Learning bounds for quantum circuits in the agnostic setting
- Numerical stability and efficiency of response property calculations in density functional theory
- Construction of maximally-localized Wannier functions using crystal symmetry
- Compatibility of DFT+U with non-collinear magnetism and spin-orbit coupling within a framework of numerical atomic orbitals
- ComDMFT: a massively parallel computer package for the electronic structure of correlated-electron systems
- Scalable GW software for quasiparticle properties using openatom
- Avogadro
- \texttt{HP} -- a code for the calculation of Hubbard parameters using density-functional perturbation theory
- CP2K
- pyFFTW
- ISOTROPY
- Mathematical modeling of semiconductor quantum dots based on the nonparabolic effective-mass approximation
- Quantum transport in disordered systems under magnetic fields: a study based on operator algebras
- iQIST
- OptaDOS
- XtalOpt
- Elliptic preconditioner for accelerating the self-consistent field iteration in Kohn-Sham density functional theory
- ShengBTE
- BerkeleyGW
- woptic
- fhi98PP
- turboTDDFT 2.0
- RESCU
- CASTEP
This page was built for software: Quantum Espresso
