Skip to content

Commit 39c7526

Browse files
fix bug
1 parent 3141442 commit 39c7526

1 file changed

Lines changed: 2 additions & 2 deletions

File tree

source/source_estate/module_charge/charge_mixing_rho.cpp

Lines changed: 2 additions & 2 deletions
Original file line numberDiff line numberDiff line change
@@ -96,8 +96,8 @@ void Charge_Mixing::mix_rho_recip(Charge* chr)
9696
}
9797
for (int ig = 0; ig < npw; ig++)
9898
{
99-
chr->rhog[0][ig] = std::max(0.0, 0.5 * (rhog_mag[ig] + rhog_mag[ig+npw]));
100-
chr->rhog[1][ig] = std::max(0.0, 0.5 * (rhog_mag[ig] - rhog_mag[ig+npw]));
99+
chr->rhog[0][ig] = 0.5 * (rhog_mag[ig] + rhog_mag[ig+npw]);
100+
chr->rhog[1][ig] = 0.5 * (rhog_mag[ig] - rhog_mag[ig+npw]);
101101
}
102102
// delete
103103
delete[] rhog_mag;

0 commit comments

Comments
 (0)