## Copyright (C) 2023 Jens
##
## This program is free software: you can redistribute it and/or modify
## it under the terms of the GNU General Public License as published by
## the Free Software Foundation, either version 3 of the License, or
## (at your option) any later version.
##
## This program is distributed in the hope that it will be useful,
## but WITHOUT ANY WARRANTY; without even the implied warranty of
## MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
## GNU General Public License for more details.
##
## You should have received a copy of the GNU General Public License
## along with this program. If not, see .
## -*- texinfo -*-
## @deftypefn {} {@var{retval} =} water_optimizer (@var{input1}, @var{input2})
##
## @seealso{}
## @end deftypefn
## Author: Jens
## Created: 2023-06-08
function water_optimizer (TEST_SUITE, k_ve, learning_rate)
# Load constants
water_constants()
# Profile from tap water
k_Ca_0_mg = 94.0; % mg/l
k_Mg_0_mg = 18.1; % mg/l
k_Na_0_mg = 3.6; % mg/l
k_S_0_mg = 44.1; % mg/l
k_Cl_0_mg = 4.6; % mg/l
k_HCO3_0_mmol = 5.5; % mmol/l
# Target Profile
k_Ca_1_mg = 50; % mg/l
k_Mg_1_mg = 20; % mg/l
k_Na_1_mg = 20; % mg/l
k_Cl_1_mg = 100; % mg/l
k_S_1_mg = 50; % mg/l
# Create common used compounds
M_CaSO4 = create_mol([i_Ca i_S i_O], [1 1 4], mol_masses)
M_CaCl2 = create_mol([i_Ca i_Cl], [1 2], mol_masses)
M_NaCl = create_mol([i_Na i_Cl], [1 1], mol_masses)
M_MgSO4 = create_mol([i_Mg i_S i_O], [1 1 4], mol_masses)
M_NaHCO3 = create_mol([i_Na i_H i_C i_O], [1 1 1 3], mol_masses)
M_HCl = create_mol([i_H i_Cl], [1 1], mol_masses)
# Create single elements
M_EL_Ca = create_mol([i_Ca], [1], mol_masses)
M_EL_Mg = create_mol([i_Mg], [1], mol_masses)
M_EL_Na = create_mol([i_Na], [1], mol_masses)
M_EL_Cl = create_mol([i_Cl], [1], mol_masses)
M_EL_S = create_mol([i_S], [1], mol_masses)
# Initial profile
M_Ca_0_mmol = k_Ca_0_mg/M_Ca; % mmol/l
M_Mg_0_mmol = k_Mg_0_mg/M_Mg; % mmol/l
M_Na_0_mmol = k_Na_0_mg/M_Na; % mmol/l
M_Cl_0_mmol = k_Cl_0_mg/M_Cl; % mmol/l
M_S_0_mmol = k_S_0_mg/M_S; % mmol/l
A0 = k_ve*create_mol([i_Ca i_Mg i_Na i_Cl i_S], [M_Ca_0_mmol M_Mg_0_mmol M_Na_0_mmol M_Cl_0_mmol M_S_0_mmol], mol_masses)
# Target profile
M_Ca_1_mmol = k_Ca_1_mg/M_Ca; % mmol/l
M_Mg_1_mmol = k_Mg_1_mg/M_Mg; % mmol/l
M_Na_1_mmol = k_Na_1_mg/M_Na; % mmol/l
M_Cl_1_mmol = k_Cl_1_mg/M_Cl; % mmol/l
M_S_1_mmol = k_S_1_mg/M_S; % mmol/l
T = create_mol([i_Ca i_Mg i_Na i_Cl i_S], [M_Ca_1_mmol M_Mg_1_mmol M_Na_1_mmol M_Cl_1_mmol M_S_1_mmol], mol_masses)
if TEST_SUITE == 1,
# Allowed substances, easy
Pp = [M_EL_Ca; M_EL_Mg; M_EL_Na; M_EL_Cl; M_EL_S];
end
if TEST_SUITE == 2,
# Allowed substances, difficult
Pp = [M_CaSO4; M_CaCl2; M_MgSO4; M_NaCl; M_HCl];
end
# Init vecfit vars
[N_subst, N_elem] = size(Pp);
Pa = zeros(N_subst, 1);
# ignore oxygen
mask = create_mol([i_Ca i_Mg i_S i_Cl i_Na], [1 1 1 1 1], mol_masses) > 0;
V = 50; % liter
_dn = [];
CONV_COUNTER_RELOAD = 20;
Dn0 = 1;
conv_counter = CONV_COUNTER_RELOAD;
while true,
[A1, Pa, Dn1] = vecfit(Pp,mask,T,A0,Pa, learning_rate.*(1-exp(-Dn0)));
Dc = round_n(Dn1,2);
if Dn0 == Dc,
if conv_counter == 0,
break;
else
conv_counter -= 1;
end
else
conv_counter = CONV_COUNTER_RELOAD;
end
Dn0 = Dc;
_dn = [_dn Dn1];
end
plot(1:length(_dn), _dn); grid();
title("Distance"); xlabel("Iteration"); ylabel("Dn")
A1=A1
Dn1 = Dn1
Pa=Pa
endfunction
function zr = round_n(z, n)
zr = round(z*10^n)/10^n;
endfunction