Skip to content

Commit 79c3697

Browse files
committed
Fix a serious bug that causes errors in GPU RT-TDDFT calculation results
1 parent dbb2b3c commit 79c3697

File tree

1 file changed

+1
-1
lines changed

1 file changed

+1
-1
lines changed

source/source_lcao/module_rt/evolve_psi.cpp

Lines changed: 1 addition & 1 deletion
Original file line numberDiff line numberDiff line change
@@ -238,7 +238,7 @@ void evolve_psi_tensor(const int nband,
238238
/// @brief compute U_operator
239239
/// @input Stmp, Htmp, print_matrix
240240
/// @output U_operator
241-
Propagator prop(propagator, pv, PARAM.mdp.md_dt);
241+
Propagator prop(propagator, pv, PARAM.inp.td_dt);
242242
prop.compute_propagator_tensor<Device>(nlocal,
243243
Stmp,
244244
Htmp,

0 commit comments

Comments
 (0)