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Library to perform I/O operations on pseudopotential data files. Please note that this is a mirror of https://gitlab.com/ElectronicStructureLibrary/libpspio.

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ElectronicStructureLibrary/libpspio

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Pspio

Library to read and write pseudopotentials in multiple formats

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Pspio performs I/O from and to pseudopotential data files so that users do not have to care about the associated specifications. It can be used to convert between pseudopotential formats to a very limited extent, when both formats store the exact same quantities.