[Pw_forum] Psuedopotential generator of José-Luís Martins

[Paolo Giannozzi]

On Thursday 14 July 2005 04:14, Shihn Lun wrote:

> I want to use pseudopotential made by José-Luís
> Martins' code in pwscf, but it doesn't seem to have
> a tool to convert to UPF.
>
> Anyone konw how to convert or where the converting
> tool is?

there is a template (any2upf.f90) in the upftools/ directory.
If you know the format of JLM's pseudopotentials, it should
be quite easy to write a converter. The UPF format is fully
documented in upftools/UPF

Paolo

-- 
Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
Scuola Normale Superiore    Phone:   +39/050-509876, Fax:-563513 
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