C interface for progress functions #262
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| @@ -88,6 +102,13 @@ if(PROGRESS_GRAPHLIB) | |||
| progress_test(prg_build_zmatGP) | |||
| endif() | |||
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| # c test modules | |||
| progress_test(prg_density_c) | |||
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All the c test names end with "_c" in order to avoid conflicts with Fortran test names.
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Now all the CI checks passed! |
examples/c_interface/scf.c
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| @@ -0,0 +1,43 @@ | |||
| #include <stdlib.h> | |||
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what is this code supposed to do? Is 'scf' a good name for it? Please add comments
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I still do not understand what this file is about. Maybe it should not be added yet?
src/prg_c_interface.F90
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| end subroutine prg_build_density_T0_c | ||
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| subroutine prg_build_density_T_c(norbs, ham_bml_c, rho_bml_c, threshold, bndfil, kbt, ef, eigenvalues_out) bind(C, name="prg_build_density_T") |
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could you split these long lines?
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Changes: 1) Removed scf.c and other commented lines; 2) Added sp2 tests. |
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hmm, two CI tests fail on sp2, will work on the fix. |
scripts/transform.py
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| def get_public(fortran_code): | ||
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| # Define the regex pattern to match lines starting with 'public ::' | ||
| pattern = re.compile(r'public ::(.*)') |
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| pattern = re.compile(r'public ::(.*)') | |
| pattern = re.compile(r'public *::(.*)') |
The standard does not require exactly one whitespace after the public keyword.
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C test for density matrix module and sp2 methods C interface for prg_chebyshev_mod module C interface for prg_charges_mod Python script to generate c wrappers and headers
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Now this PR can be merged. Thanks. |
C test for density matrix module (passed!)
Python script to generate c wrappers and headers
Add c interface for prg_chebyshev_mod module (Tests TBA)
Add c interface for prg_charges_mod (Tests TBA)
PS:
This change is