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Fixed nested parallelism in cholesky
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Anthony Scemama 2024-03-20 09:20:21 +01:00
parent 1839809432
commit 7aff1a33a9
1 changed files with 2 additions and 1 deletions
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src/ao_two_e_ints/cholesky.irp.f
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@ -66,7 +66,8 @@ END_PROVIDER
else
PROVIDE nucl_coord
PROVIDE nucl_coord ao_two_e_integral_schwartz
call set_multiple_levels_omp(.False.)
if (do_direct_integrals) then
if (ao_two_e_integral(1,1,1,1) < huge(1.d0)) then