From 9eaaff3df861ece65481bba82f18c77666aa08b9 Mon Sep 17 00:00:00 2001 From: Ben Hourahine Date: Thu, 25 Jan 2024 16:09:07 +0000 Subject: [PATCH] Clarify error message a bit for users --- src/dftbp/timedep/timeprop.F90 | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/src/dftbp/timedep/timeprop.F90 b/src/dftbp/timedep/timeprop.F90 index 662cb85392..775c687c2c 100644 --- a/src/dftbp/timedep/timeprop.F90 +++ b/src/dftbp/timedep/timeprop.F90 @@ -883,8 +883,8 @@ subroutine TElecDynamics_init(this, inp, species, speciesName, tWriteAutotest, a if (this%tIons) then if (.not. this%tRealHS) then - @:RAISE_ERROR(errStatus, -1, "Ion dynamics is not implemented yet for imaginary& - & Hamiltonians.") + @:RAISE_ERROR(errStatus, -1, "Ion dynamics is not implemented yet for complex& + & hamiltonians (k-points, spin-orbit, ...).") end if this%tForces = .true. this%indMovedAtom = inp%indMovedAtom