[Pw_forum] UPF-PP File Naming Convention

Paul M. Grant w2agz at pacbell.net
Wed Jan 16 04:36:45 CET 2008


The file naming convention within the library of PPs on O-Sesame and PWscf
seems rather arcane.  I can figure out most, but one that has me stumped is
-d- vs -nd-.  "d-orbitals," "norm-conserving?"

Paul M. Grant, PhD
Principal, W2AGZ Technologies
Visiting Scholar, Applied Physics, Stanford University
EPRI Science Fellow (Retired)
IBM Research Staff Member Emeritus
w2agz at pacbell.net
http://www.w2agz.com
 
 


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