8/20/2023 0 Comments Waves v9 tutorialWith the JTH PAW atomic data table on the ABINIT web site. The use of PAW atomic data (equivalent to pseudopotential file for the norm-Ĭonserving case) automatically launch a PAW calculation. The way the PAW method is implemented with planewaves in ABINIT is described Topic_Wavelets for its use with wavelets. Specificities of PAW for use with planewaves are presented here. The PAW atomic data can be used with plane waves as well as with wavelets. This page gives hints on how to set parameters for a PAW calculation with the ABINIT package. YAML-based test suite Python tools and API Zero-point renormalization of the band gap and temperature-dependent band gaps Tutorial on polarization and finite electric fields Calculation of *U* and J using Cococcioni's approach
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