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lapw

Here are 3 public repositories matching this topic...

SIRIUS

electronic-structure / SIRIUS

Domain specific library for electronic structure calculations

gpu mpi cuda density-functional-theory rocm electronic-structure-calculations pseudopotential planewave full-potential lapw

Updated Sep 1, 2026
C++

FLEUR

JuDFTteam / FLEUR

Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)

Updated Sep 2, 2026
Fortran

aromanro / APW

Augmented Plane Waves (both APW and LAPW), band structure computation

quantum-mechanics computational-physics vtk wxwidgets-applications condensed-matter schrodinger-equation electronic-structure electronic-structure-calculations apw vtk-applications numerov wx-widgets condensed-matter-physics augmented-plane-waves lapw numerov-method

Updated Dec 31, 2025
C++

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