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A tool for generating atomic pseudopotentials within a Density-Functional Theory framework.APE (Atomic Pseudopotentials Engine) is a computer package designed to generate and test norm-conserving pseudo-potentials within Density Functional Theory. The generated pseudo-potentials can be either non-relativistic, scalar relativistic or fully relativistic and can explicitly include semi-core states. A wide range of exchange-correlation functionals is included. APE can generate pseudopotential files for use with SIESTA, Abinit, Octopus, and Quantum Espresso.
Version: 2.3.1 License: GPL-2+
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2025-Jan-08 to 2025-Feb-07
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