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increase number of points
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ahurta92 committed Jul 1, 2024
1 parent be78032 commit 7fa8820
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion src/apps/molresponse/response_parameters.h
Original file line number Diff line number Diff line change
Expand Up @@ -38,7 +38,7 @@ namespace madness {
initialize<std::vector<double>>("plot_cell", std::vector<double>(),
"lo-hi plot cell (default is all space)");
initialize<double>("plot_l", -1.0, "Controls the plotting box size");
initialize<size_t>("plot_pts", 51, "Controls number of points in plots");
initialize<size_t>("plot_pts", 81, "Controls number of points in plots");
initialize<bool>("plot_all_orbitals", false, "Turn on 2D plotting of response orbitals ");
initialize<size_t>("maxiter", 25, "maximum number of iterations");
initialize<double>("dconv", 1.e-4, "recommended values: 1.e-4 < dconv < 1.e-8");
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