35 lines
2.4 KiB
Matlab
35 lines
2.4 KiB
Matlab
close all
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clear
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clc
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%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
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% Input %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
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%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
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% See Further Documentation in DC.m
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filename = 'PBA 2 Raman.txt'; % File name
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range = 'all'; % 'all - Deconvolutes the full range, or [minx maxx]
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np = 9; % Number of peaks
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bg = 'bg2'; % Type of background ('bg1' - constant background, 'bg2','bg3' - sloped, 's' - shirley)
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mode = 1; % Type of peak (1 - Voigt, 2 - Lognormal)
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IG = 'full'; % Type of initial guess, 'auto' - peak location suggestion and automatic
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% initial guess generation and bounds.
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% 'full' - same as 'auto', but you can
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% change initial guess and bounds
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% during fitting.
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% Uncomment next four lines for manual initial guess and lower
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% and upper bounds:
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%1 2 3 4 5 6 7
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% parvec0 = [802 ,284.1 ,0.5 ,1.12 ,10000 ,284.7 ,0.5 ,1.5 ,2240 ,285.5 ,0.5 ,0.7 ,500 ,286 ,0.5 ,1.4 ,353 ,287.5 ,0.5 ,1.31 ,133 ,289 ,0.5 ,2 ,399 ,290.5 ,0.5 ,1];
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% lb = [500 ,284 ,0 ,0 ,0 ,284.5 ,0 ,0.5 ,0 ,285.3 ,0 ,0 ,0 ,286 ,0 ,0 ,0 ,287.3 ,0 ,0 ,0 ,288.6 ,0 ,0 ,0 ,290 ,0 ,0];
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% ub = [20000 ,284.5 ,1 ,4.75 ,20000 ,284.9 ,1 ,4.75 ,20000 ,285.6 ,1 ,4.75 ,20000 ,286.70 ,1 ,4.75 ,20000 ,287.9 ,1 ,4.75 ,20000 ,289.4 ,1 ,4.75 ,20000 ,295 ,1 ,3];
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% IG = [parvec0 ; lb ; ub];
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% Uncomment next two lines for manual initial guess and automatic lower and
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% upper bounds:
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% parvec0 = [5,10,22,0,13,15,27,1,15,20,60,0,33,10,80,1,10];
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% IG = parvec0;
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%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
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% Deconvolution %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
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%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
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[ parameters,lb,ub,conf,graphdata,resnorm,residual,r2 ] = DC( filename , 'range' , range , 'np' , np , bg , 'IG' , IG , 'mode' , mode ); |