Plane wave density functional theory using Julia programming language
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Updated
Sep 16, 2024 - Julia
Plane wave density functional theory using Julia programming language
A library to parse CP2K basis sets and GTH pseudopotentials, which also comes with a webserver to find out and select a basis set and its matching pseudopotential for your CP2K calculations.
The official repository of the oncvpsp code to generate optimized norm-conserving Vanderbilt pseudopotentials
All in one place to find various pseudopotentials.
Projector Augmented Wave Dataset For Actinides
Python framework for generating and validating pseudo potentials
Pseudopotential converter from upf to psp8
SPMS table of pseudopotentials
Modernized version of a pseudopotential generation code
SG15 pseudopotentials in psp8 converted from the upf files
A library of ultrasoft and PAW pseudopotentials
A Julia package that provides operations of a database with pseudopotential datasets
Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
Computes the electronic band structure of Zinc Blende semiconductor
Pseudopotential Studio
My own devel version of Quantum-Espresso
Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
Bandstructure calculations using the empirical pseudopotential method.
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