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Adjust string length
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Thomas3R committed Sep 13, 2024
1 parent d16dc3d commit 5809f8a
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2 changes: 1 addition & 1 deletion test/unit/molstock.f90
Original file line number Diff line number Diff line change
Expand Up @@ -57,7 +57,7 @@ subroutine getMolecule(mol, name)
case ('mgh2'); call MgH2(mol)
case ('x06_b'); call x06_benzene(mol)
case ('mcv15'); call mcv15(mol)
case ('Th_1519394'); call Th_1519394(mol)
case ('Th_15'); call Th_1519394(mol)
case ('Ce_0a7745'); call Ce_0a7745(mol)
end select

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2 changes: 1 addition & 1 deletion test/unit/test_gfnff.f90
Original file line number Diff line number Diff line change
Expand Up @@ -705,7 +705,7 @@ subroutine test_gfnff_pbc(error)
logical, parameter :: pbc(3) = [.true., .true., .true. ]
! structures from X23, mcVOL22, and GFN-FF for Ln/An paper
character(len=*), parameter :: pbc_strucs(3) = [&
& "x06_b", "mcv15", "Th_1519394"]
& "x06_b", "mcv15", "Th_15"]
!> references for original GFN-FF
real(wp), parameter :: ref_energies(3) = &
& [-9.522300429916_wp, -11.059826732607_wp, -46.265672914_wp ]
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