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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+ GitHub
Maintainers dstrubbe
Categories science
Homepage http://www.tddft.org/programs/APE
Platforms darwin
Variants
  • gcc10 (Build using the MacPorts gcc 10 compiler)
  • gcc11 (Build using the MacPorts gcc 11 compiler)
  • gcc5 (Build using the MacPorts gcc 5 compiler)
  • gcc6 (Build using the MacPorts gcc 6 compiler)
  • gcc7 (Build using the MacPorts gcc 7 compiler)
  • gcc8 (Build using the MacPorts gcc 8 compiler)
  • gcc9 (Build using the MacPorts gcc 9 compiler)
  • gccdevel (Build using the MacPorts gcc devel compiler)
  • gfortran (Build using the MacPorts gcc 11 Fortran compiler)

"ape" depends on

lib (3)
build (2)

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ape seems to have been updated (port version: 2.3.1, new version: 2.3.2)

livecheck ran: 4 hours ago