From 43e70d8f063f2d9f9b436bd2ce202e3902664794 Mon Sep 17 00:00:00 2001 From: renchao_lu <renchao.lu@gmail.com> Date: Sat, 13 Jul 2019 16:34:47 +0200 Subject: [PATCH] [CL] Updates in reading phreeqc result file. --- ChemistryLib/PhreeqcIO.cpp | 12 ++++++------ 1 file changed, 6 insertions(+), 6 deletions(-) diff --git a/ChemistryLib/PhreeqcIO.cpp b/ChemistryLib/PhreeqcIO.cpp index cde24306b38..5f3db46374e 100644 --- a/ChemistryLib/PhreeqcIO.cpp +++ b/ChemistryLib/PhreeqcIO.cpp @@ -345,10 +345,8 @@ std::istream& operator>>(std::istream& in, PhreeqcIO& phreeqc_io) auto& aqueous_solution = phreeqc_io._aqueous_solutions[chemical_system_id]; auto& components = aqueous_solution.components; - auto& equilibrium_phases = - phreeqc_io._equilibrium_phases[chemical_system_id]; - auto& kinetic_reactants = - phreeqc_io._kinetic_reactants[chemical_system_id]; + auto& equilibrium_phases = phreeqc_io._equilibrium_phases; + auto& kinetic_reactants = phreeqc_io._kinetic_reactants; for (int item_id = 0; item_id < static_cast<int>(accepted_items.size()); ++item_id) { @@ -390,7 +388,8 @@ std::istream& operator>>(std::istream& in, PhreeqcIO& phreeqc_io) compare_by_name, "Could not find equilibrium phase '" + item_name + "'."); - equilibrium_phase.amount = accepted_items[item_id]; + (*equilibrium_phase.amount)[chemical_system_id] = + accepted_items[item_id]; break; } case ItemType::KineticReactant: @@ -400,7 +399,8 @@ std::istream& operator>>(std::istream& in, PhreeqcIO& phreeqc_io) kinetic_reactants.begin(), kinetic_reactants.end(), compare_by_name, "Could not find kinetic reactant '" + item_name + "'."); - kinetic_reactant.amount = accepted_items[item_id]; + (*kinetic_reactant.amount)[chemical_system_id] = + accepted_items[item_id]; break; } } -- GitLab