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Add KAIN back in
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ahurta92 committed Jul 1, 2024
1 parent b9c4a16 commit 77844ae
Showing 1 changed file with 2 additions and 2 deletions.
4 changes: 2 additions & 2 deletions src/apps/molresponse/testing/runners.hpp
Original file line number Diff line number Diff line change
Expand Up @@ -555,8 +555,8 @@ void set_frequency_response_parameters(World &world, ResponseParameters &r_param
}
//r_params.set_user_defined_value("archive", std::string("../restartdata"));
r_params.set_user_defined_value("maxiter", size_t(35));
r_params.set_user_defined_value("maxsub", size_t(5));
r_params.set_user_defined_value("kain", false);
r_params.set_user_defined_value("maxsub", size_t(10));
r_params.set_user_defined_value("kain", true);
r_params.set_user_defined_value("omega", frequency);
r_params.set_user_defined_value("first_order", true);
r_params.set_user_defined_value("plot_all_orbitals", true);
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