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 of ultrasoft and PAW pseudopotentials
Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
Python framework for generating and validating pseudo potentials
SPMS table of pseudopotentials
Pseudopotential Studio
Computes the electronic band structure of Zinc Blende semiconductor
The official repository of the oncvpsp code to generate optimized norm-conserving Vanderbilt pseudopotentials
Pseudopotential converter from upf to psp8
Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
Bandstructure calculations using the empirical pseudopotential method.
Projector Augmented Wave Dataset For Actinides
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.
Modernized version of a pseudopotential generation code
A Julia package that provides operations of a database with pseudopotential datasets
My own devel version of Quantum-Espresso
SG15 pseudopotentials in psp8 converted from the upf files
All in one place to find various pseudopotentials.
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