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License: MIT License
The Atomic Structure Package
License: MIT License
There is an error in the atsp/utill/lsgen.f file
The declaration of line 4472
integer rank(0:noofco,4,15),antal,pos(0:noofco),i,j,k,no,
should be the same as in all other routines, namely
integer rank(0:noofco, 0:10, 15),antal,pos(0:noofco),i,j,k,no,
Also, all of the repository should have execute permissions removed for *.f files.
There are times when it is important to know details about a calculation. This could be achieved by having a global flag that determines the level of output.
Level 0 -- only results
Level 1 -- some general information such as whether the calculation was done in memory or with disk.
Level 2 -- more information
Level 3 -- extensive details
The "book version" that was the basis for the book, Computational Atomic Structure: An MCHF approach, was an early program that produced output for energy expressions, and other details that are helpful for understanding a calculation. The level structure for output facilitates the control of output.
There is an error in the declaration of OF(30). Since NWFD=20
if should be either OF(20) or OF(NWFD) foe more general declation.
With this declaration Hf compiles only with warnings.
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