?? d9r8a.cpp
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#include "iostream.h"
#include "math.h"
#include "stdlib.h"
#include "conio.h"
void gaussj(double a[], int n, int ma,double b[])
{
int i,j,k,l,ll,irow,icol;
double big,pivinv,dum;
int ipiv[51], indxr[51], indxc[51];
for (j=1;j<=n;j++)
{
ipiv[j]=0;
}
for (i=1;i<=n;i++)
{
big=0.0;
for (j=1;j<=n;j++)
{
if(ipiv[j]!=1)
{
for(k=1;k<=n;k++)
{
if(ipiv[k]==0)
{
if(fabs(a[(j-1)*ma+k])>=big)
{
big=fabs(a[(j-1)*ma+k]);
irow=j;
icol=k;
}
else if(ipiv[k]>1)
{
cout<<"singular matrix";
}
}
}
}
}
ipiv[icol]=ipiv[icol]+1;
if(irow!=icol)
{
for(l=1;l<=n;l++)
{
dum=(a[(irow-1)*ma+l]);
a[(irow-1)*ma+l]=a[(icol-1)*ma+l];
a[(icol-1)*ma+l]=dum;
}
dum=b[irow];
b[irow]=b[icol];
b[icol]=dum;
}
indxr[i]=irow;
indxc[i]=icol;
if(a[(icol-1)*ma+icol]==0.0)
{
cout<< "singular matrix.";
}
pivinv=1.0/(a[(icol-1)*ma+icol]);
a[(icol-1)*ma+icol]=1.0;
for(l=1;l<=n;l++)
{
a[(icol-1)*ma+l]=a[(icol-1)*ma+l]*pivinv;
}
b[icol]=b[icol]*pivinv;
for(ll=1;ll<=n;ll++)
{
if(ll!=icol)
{
dum=a[(ll-1)*ma+icol];
a[(ll-1)*ma+icol]=0.0;
for(l=1;l<=n;l++)
{
a[(ll-1)*ma+l]=a[(ll-1)*ma+l]-a[(icol-1)*ma+l]*dum;
}
b[ll]=b[ll]-b[icol]*dum;
}
}
}
for(l=n;l>=1;l--)
{
if(indxr[l]!=indxc[l])
{
for(k=1;k<=n;k++)
{
dum=a[(k-1)*ma+indxr[l]];
a[(k-1)*ma+indxr[l]]=a[(k-1)*ma+indxc[l]];
a[(k-1)*ma+indxr[l]]=dum;
}
}
}
}
double ran1(long& idum)
{
int j,iff=-1;
static long ix1,ix2,ix3;
static double r[98];
long m1 = 259200; long m2 = 134456; long m3 = 243000;
long ia1 = 7141; long ia2 = 8121; long ia3 = 4561;
long ic1 = 54773; long ic2 = 28411; long ic3 = 51349;
double rm1 = 0.0000038580247; double rm2 = 0.0000074373773;
if (idum < 0 || iff == 0)
{
iff = 1;
ix1 = (ic1 - idum) % m1;
ix1 = (ia1 * ix1 + ic1) % m1;
ix2 = ix1 % m2;
ix1 = (ia1 * ix1 + ic1) % m1;
ix3 = ix1 % m3;
for (j = 1; j<=97; j++)
{
ix1 = (ia1 * ix1 + ic1) % m1;
ix2 = (ia2 * ix2 + ic2) % m2;
r[j] = (double(ix1) + double(ix2) * rm2) * rm1;
}
idum = 1;
}
ix1 = (ia1 * ix1 + ic1) % m1;
ix2 = (ia2 * ix2 + ic2) % m2;
ix3 = (ia3 * ix3 + ic3) % m3;
j = 1 + int((97 * ix3) / m3);
if (j > 97 || j < 1)
{
cout<<"abnormal exit in ran1"<<endl;
exit(1);
}
double temp=r[j];
r[j] = (double(ix1) + double(ix2) * rm2) * rm1;
return temp;
}
double gasdev(long& idum)
{
static int iset;
static double gset;
double v1,v2,r,fac;
if (iset == 0)
{
do
{
v1 = 2.0 * ran1(idum) - 1.0;
v2 = 2.0 * ran1(idum) - 1.0;
r = v1 * v1 + v2 * v2;
}while (r >= 1.0 || r == 0);
fac = sqrt(-2.0 * log(r) / r);
gset = v1 * fac;
iset = 1;
return v2 * fac;
}
else
{
iset = 0;
return gset;
}
}
void covsrt(double covar[], int ncvm, int ma, int lista[], int mfit)
{
int i,j;
double swap;
for (j = 1; j<=ma - 1; j++)
{
for (i = j + 1; i<=ma; i++)
{
covar[(i-1)*ma+j] = 0.0;
}
}
for (i = 1; i<=mfit - 1; i++)
{
for (j = i + 1; j<=mfit; j++)
{
if (lista[j] > lista[i])
{
covar[(lista[j]-1)*ma+lista[i]] = covar[(i-1)*ma+j];
}
else
{
covar[(lista[i]-1)*ma+lista[j]] = covar[(i-1)*ma+j];
}
}
}
swap = covar[1];;
for (j = 1; j<=ma; j++)
{
covar[j] = covar[(j-1)*ma+j];
covar[(j-1)*ma+j] = 0.0;
}
covar[(lista[1]-1)*ma+lista[1]] = swap;
for (j = 2; j<=mfit; j++)
{
covar[(lista[j]-1)*ma+lista[j]] = covar[j];
}
for (j = 2; j<=ma; j++)
{
for (i = 1; i<=j - 1; i++)
{
covar[(i-1)*ma+j] = covar[(j-1)*ma+i];
}
}
}
void fgauss(double x, double a[], double& y, double dyda[], int na)
{
y = 0.0;
for (int i = 1; i<=na - 1; i=i+3)
{
double arg = (x - a[i + 1]) / a[i + 2];
double ex = exp(-(arg * arg));
double fac = a[i] * ex * 2.0 * arg;
y = y + a[i] * ex;
dyda[i] = ex;
dyda[i + 1] = fac / a[i + 2];
dyda[i + 2] = fac * arg / a[i + 2];
}
}
void mrqcof(double x[], double y[], double sig[], int ndata, double a[],
int ma, int lista[], int mfit, double alpha[], double beta[],
int nalp, double& chisq)
{
int i,j,k;
double wt,ymod,sig2i,dy;
double dyda[21];
for (j = 1; j<=mfit; j++)
{
for (k = 1; k<=j; k++)
{
alpha[(j-1)*nalp+k] = 0.0;
}
beta[j] = 0.0;
}
chisq = 0.0;
for (i = 1; i<=ndata; i++)
{
fgauss(x[i], a, ymod, dyda, ma);
sig2i = 1.0 / (sig[i] * sig[i]);
dy = y[i] - ymod;
for (j = 1; j<=mfit; j++)
{
wt = dyda[lista[j]] * sig2i;
for (k = 1; k<=j; k++)
{
alpha[(j-1)*nalp+k] = alpha[(j-1)*nalp+k] + wt * dyda[lista[k]];
}
beta[j] = beta[j] + dy * wt;
}
chisq = chisq + dy * dy * sig2i;
}
for (j = 2; j<=mfit; j++)
{
for (k = 1; k<=j - 1; k++)
{
alpha[(k-1)*nalp+j] = alpha[(j-1)*nalp+k];
}
}
}
void mrqmin(double x[], double y[], double sig[], int ndata, double a[],
int ma, int lista[], int mfit, double covar[], double alpha[],
int nca, double& chisq, double& alamda)
{
static kk,i,j,k,ihit;
static double atry[21], beta[21], da[21];
static double ochisq;
if (alamda < 0.0)
{
kk = mfit + 1;
for (j = 1; j<=ma; j++)
{
ihit = 0;
for (k = 1; k<=mfit; k++)
{
if (lista[k] == j)
{
ihit = ihit + 1;
}
}
if (ihit == 0)
{
lista[kk] = j;
kk = kk + 1;
}
else
{
if (ihit > 1)
{
cout<< "improper permutation in lista"<<endl;
return;
}
}
}
if (kk != ma + 1)
{
cout<< "improper permutation in lista"<<endl;
}
alamda = 0.001;
mrqcof(x, y, sig, ndata, a, ma, lista, mfit, alpha, beta, nca, chisq);
ochisq = chisq;
for (j = 1; j<=ma; j++)
{
atry[j] = a[j];
}
}
for (j = 1; j<=mfit; j++)
{
for (k = 1; k<=mfit; k++)
{
covar[(j-1)*nca+k] = alpha[(j-1)*nca+k];
}
covar[(j-1)*nca+j] = alpha[(j-1)*nca+j] * (1.0 + alamda);
da[j] = beta[j];
}
gaussj(covar, mfit, nca, da);
if (alamda == 0.0)
{
covsrt(covar, nca, ma, lista, mfit);
for (i=1; i<=20; i++)
{
da[i]=0;
atry[i]=0;
}
return;
}
for (j = 1; j<=mfit; j++)
{
atry[lista[j]] = a[lista[j]] + da[j];
}
mrqcof(x, y, sig, ndata, atry, ma, lista, mfit, covar, da, nca, chisq);
if (chisq < ochisq)
{
alamda = 0.1 * alamda;
ochisq = chisq;
for (j = 1; j<=mfit; j++)
{
for (k = 1; k<=mfit; k++)
{
alpha[(j-1)*nca+k] = covar[(j-1)*nca+k];
}
beta[j] = da[j];
a[lista[j]] = atry[lista[j]];
}
}
else
{
alamda = 10.0 * alamda;
chisq = ochisq;
}
for (i=1; i<=20; i++)
{
da[i]=0;
atry[i]=0;
}
}
void main()
{
//program d9r8a
//driver for routine mrqmin
int i,j,npt = 100;
int mfit,ma = 6;
double ochisq,chisq,spread = 0.001;
double x[101], y[101], sig[101], a[7];
int lista[7];
double covar[37], alpha[37], gues[7];
a[1] = 5.0; a[2] = 2.0; a[3] = 3.0; a[4] = 2.0; a[5] = 5.0; a[6] = 3.0;
gues[1] = 4.5; gues[2] = 2.2; gues[3] = 2.8;
gues[4] = 2.5; gues[5] = 4.9; gues[6] = 2.8;
long idum = -911;
//first try a sum of two gaussians
for (i = 1; i<=100; i++)
{
x[i] = 0.1 * i;
y[i] = 0.0;
for (j = 1; j<=4; j=j+3)
{
y[i] = y[i] + a[j] * exp(-pow(((x[i] - a[j + 1]) / a[j + 2]), 2));
}
y[i] = y[i] * (1.0 + spread * gasdev(idum));
sig[i] = spread * y[i];
}
mfit = ma;
for (i = 1; i<=mfit; i++)
{
lista[i] = i;
}
double alamda = -1;
for (i = 1; i<=ma; i++)
{
a[i] = gues[i];
}
mrqmin(x, y, sig, npt, a, ma, lista, mfit, covar, alpha, ma, chisq, alamda);
int k = 1;
int itst = 0;
cout.setf(ios::left);
do
{
cout<<"Iteration #"<<k<<" Chi-squared: ";
cout<<chisq;
cout<<" alamda: "<<alamda;
cout<<endl;
cout<<endl;
cout<<" a(1) a(2) a(3) a(4) a(5) a(6)"<<endl;
cout<<endl;
for (i = 1; i<=ma; i++)
{
cout.precision(5);
cout<<" ";
cout.width(9);
cout<<a[i];
}
cout<<endl;
k = k + 1;
ochisq = chisq;
mrqmin(x, y, sig, npt, a, ma, lista, mfit, covar, alpha, ma, chisq, alamda);
if (chisq > ochisq)
{
itst = 0;
}
else
{
if (fabs(ochisq - chisq) < 0.1)
{
itst = itst + 1;
}
}
cout<<"press any key to continue...."<<endl;
getch();
}while(itst < 2);
alamda = 0.0;
mrqmin(x, y, sig, npt, a, ma, lista, mfit, covar, alpha, ma, chisq, alamda);
cout<<endl;
cout<<endl;
cout<<"Uncertainties:"<<endl;
cout<<endl;
for (i = 1; i<=ma; i++)
{
cout<<" ";
cout.width(9);
cout.precision(3);
cout<<sqrt(covar[(i-1)*ma+i]);
}
cout<<endl;
cout<<endl;
cout<<"Expected results:"<<endl;
cout<<endl;
cout<<" 5.0 2.0 3.0 2.0 5.0 3.0"<<endl;
cout<<endl;
}
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