diff --git a/data/digitized/expData_zech_aStructuralModelFor_qBand.csv b/data/digitized/expData_zech_aStructuralModelFor_qBand.csv
index d5557a8ee5b516571971c49a2aca8f96b151a183..0d024600a43122a9cad593cead8e7ed892a1a8cd 100644
--- a/data/digitized/expData_zech_aStructuralModelFor_qBand.csv
+++ b/data/digitized/expData_zech_aStructuralModelFor_qBand.csv
@@ -1,875 +1,194 @@
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diff --git a/data/digitized/expData_zech_aStructuralModelFor_qBandDeut.mat b/data/digitized/expData_zech_aStructuralModelFor_qBandDeut.mat
new file mode 100644
index 0000000000000000000000000000000000000000..fafa9ef6d1589065da5f1de637f91e1f637c47db
Binary files /dev/null and b/data/digitized/expData_zech_aStructuralModelFor_qBandDeut.mat differ
diff --git a/data/digitized/expData_zech_aStructuralModelFor_wBand.csv b/data/digitized/expData_zech_aStructuralModelFor_wBandDeut.csv
similarity index 100%
rename from data/digitized/expData_zech_aStructuralModelFor_wBand.csv
rename to data/digitized/expData_zech_aStructuralModelFor_wBandDeut.csv
diff --git a/data/digitized/expData_zech_aStructuralModelFor_wBand.mat b/data/digitized/expData_zech_aStructuralModelFor_wBandDeut.mat
similarity index 100%
rename from data/digitized/expData_zech_aStructuralModelFor_wBand.mat
rename to data/digitized/expData_zech_aStructuralModelFor_wBandDeut.mat
diff --git a/data/digitized/expData_zech_aStructuralModelFor_xBand.csv b/data/digitized/expData_zech_aStructuralModelFor_xBandDeut.csv
similarity index 100%
rename from data/digitized/expData_zech_aStructuralModelFor_xBand.csv
rename to data/digitized/expData_zech_aStructuralModelFor_xBandDeut.csv
diff --git a/data/digitized/expData_zech_aStructuralModelFor_xBand.mat b/data/digitized/expData_zech_aStructuralModelFor_xBandDeut.mat
similarity index 100%
rename from data/digitized/expData_zech_aStructuralModelFor_xBand.mat
rename to data/digitized/expData_zech_aStructuralModelFor_xBandDeut.mat
diff --git a/from_bittl/PSI_trEPR/p2.txt b/from_bittl/PSI_trEPR/p2.txt
index c0c5c0ba04927c23fb1499c3fab70b49c24ae354..c3c453b47988d841277056f871152524437315f5 100755
--- a/from_bittl/PSI_trEPR/p2.txt
+++ b/from_bittl/PSI_trEPR/p2.txt
@@ -1,14 +1,14 @@
-9700.                MIKROWELLEN-FREQUENZ
-3436. 3476. 501      MAGNETFELD
-91 91                   GENAUIGKEIT
-2.00300 0.00000 0.00000
-0.00000 2.00260 0.00000
-0.00000 0.00000 2.00230 G-TENSOR P700+
-0.35                    LINIENBREITE P
+94000.                MIKROWELLEN-FREQUENZ
+33455. 33566.2 301      MAGNETFELD
+181 91                   GENAUIGKEIT
+2.00308 0.00000 0.00000
+0.00000 2.00263 0.00000
+0.00000 0.00000 2.00225 G-TENSOR P700+
+3.1                    LINIENBREITE P
 2.00620 0.00000 0.00000
-0.00000 2.00510 0.00000
+0.00000 2.00507 0.00000
 0.00000 0.00000 2.00220 G-TENSOR Qb-
-0.35                     LINIENBREITE Q
+2.5                     LINIENBREITE Q
 Q                       REFERENZSYSTEM
 0.0  90.0    		PHI,THETA
 83.0 128.0 10.0   	ALPHA,BETA,GAMMA
@@ -20,14 +20,14 @@ test2                   OUTPUT_FILENAME
 31.25 512                MAX.ESEEM-FT-FREQUENZ,FREQ-PUNKTE
 256                      HYPERFEIN_SCHRITTE
 0.                     LORENTZ_BREITE(MHz)
-0                       ANZAHL_DER_PROTONEN_AM_A1-
+3                       ANZAHL_DER_PROTONEN_AM_A1-
 -10.25 -1.472  0.000
 -1.472 -11.95  0.000
 0.000  0.000 -9.000
 0                       ANZAHL_DER_PROTONEN_AM_P+
- 0.1  0.0  0.0
- 0.0  0.1  0.0
- 0.0  0.0  0.1
+ 0.  0.0  0.0
+ 0.0  0.  0.0
+ 0.0  0.0  0.
 
 10.25  1.472  0.000
  1.472 11.95  0.000
@@ -38,3 +38,5 @@ test2                   OUTPUT_FILENAME
  0.0  0.0 -3.5       
 
  HFC Tensor A1- (9.4,12.8,9.0) 30 grd gedreht.
+ 3436. 3476. 501      MAGNETFELD
+
diff --git a/from_bittl/PSI_trEPR/test2_Pabs.asc b/from_bittl/PSI_trEPR/test2_Pabs.asc
index 0a63433e3e07e0f40183c4f78f349c11226943e3..66169516cdc8f1d41dfde74a9bb1329a671d5dc0 100755
--- a/from_bittl/PSI_trEPR/test2_Pabs.asc
+++ b/from_bittl/PSI_trEPR/test2_Pabs.asc
@@ -1,501 +1,301 @@
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diff --git a/from_bittl/PSI_trEPR/test2_Pem.asc b/from_bittl/PSI_trEPR/test2_Pem.asc
index 65f4fc97d03e7c34a8e6e86d87da46995ded1c40..5091890cfebe98570cbcf191567112a33907b7b9 100755
--- a/from_bittl/PSI_trEPR/test2_Pem.asc
+++ b/from_bittl/PSI_trEPR/test2_Pem.asc
@@ -1,501 +1,301 @@
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diff --git a/from_bittl/PSI_trEPR/test2_Qabs.asc b/from_bittl/PSI_trEPR/test2_Qabs.asc
index 8f82a2a65dead64d4673df5b4bb32254a0b06fa1..662bf2592287784c69bc32a95e4af4de06165771 100755
--- a/from_bittl/PSI_trEPR/test2_Qabs.asc
+++ b/from_bittl/PSI_trEPR/test2_Qabs.asc
@@ -1,501 +1,301 @@
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diff --git a/from_bittl/PSI_trEPR/test2_Qem.asc b/from_bittl/PSI_trEPR/test2_Qem.asc
index 5bed21da3ca8aacac9456c0c5f52e6740043c2ad..2f483195428a4207cce9f01ccd852f66a6528f7a 100755
--- a/from_bittl/PSI_trEPR/test2_Qem.asc
+++ b/from_bittl/PSI_trEPR/test2_Qem.asc
@@ -1,501 +1,301 @@
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diff --git a/from_bittl/PSI_trEPR/test2_spec.asc b/from_bittl/PSI_trEPR/test2_spec.asc
index 788fbd738f0b1e497c71f526c6035688bde00615..f09407ab624143ef86d39774f043f5e88e1e51e1 100755
--- a/from_bittl/PSI_trEPR/test2_spec.asc
+++ b/from_bittl/PSI_trEPR/test2_spec.asc
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diff --git a/from_bittl/PSI_trEPR/test2_sum.asc b/from_bittl/PSI_trEPR/test2_sum.asc
index 788fbd738f0b1e497c71f526c6035688bde00615..f09407ab624143ef86d39774f043f5e88e1e51e1 100755
--- a/from_bittl/PSI_trEPR/test2_sum.asc
+++ b/from_bittl/PSI_trEPR/test2_sum.asc
@@ -1,501 +1,301 @@
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diff --git a/util/averageOverSolidAngle.asv b/util/averageOverSolidAngle.asv
new file mode 100644
index 0000000000000000000000000000000000000000..f811bd0da4de3e7db18505115ee269fdbed083ae
--- /dev/null
+++ b/util/averageOverSolidAngle.asv
@@ -0,0 +1,19 @@
+function outV = averageOverSolidAngle(inV, nTheta, nPhi, dim)
+
+[thetas, ~] = createthetaphigrid(nTheta, nPhi);
+
+if numel(dim) == 1
+    thetas = repmat(thetas, [nPhi, 1]);
+    weight = sin(thetas)/sum(thetas);
+    size(weight)
+    outV = sum(weight.*inV, dim);
+    outV = squeeze(outV);
+else
+    weight = sin(thetas)/sum(sin(thetas)*ones(1, nPhi), 'all');
+
+    weight = reshape(weight, [ones(1, dim(1) - 1), nTheta]);
+    outV = sum(weight.*inV, dim);
+    outV = squeeze(outV);
+end
+end
+
diff --git a/util/averageoversolidangle.m b/util/averageoversolidangle.m
new file mode 100644
index 0000000000000000000000000000000000000000..8562386d0a8df6ec390bb9fc77c18de13f5beda7
--- /dev/null
+++ b/util/averageoversolidangle.m
@@ -0,0 +1,22 @@
+function outV = averageoversolidangle(inV, nTheta, nPhi, dim)
+
+[thetas, ~] = createthetaphigrid(nTheta, nPhi);
+
+if numel(dim) == 1
+    thetas = repmat(thetas, [nPhi, 1]);
+    weight = sin(thetas);
+    weight = weight/sum(weight);
+
+    weight = reshape(weight, [ones(1, dim - 1), nTheta*nPhi]);
+
+    outV = sum(weight.*inV, dim);
+    outV = squeeze(outV);
+else
+    weight = sin(thetas)/sum(sin(thetas)*ones(1, nPhi), 'all');
+
+    weight = reshape(weight, [ones(1, min(dim(1) - 1, 1)), nTheta]);
+    outV = sum(weight.*inV, dim);
+    outV = squeeze(outV);
+end
+end
+
diff --git a/util/calculateaplusaminusnohfi.m b/util/calculateaplusaminusnohfi.m
new file mode 100755
index 0000000000000000000000000000000000000000..6812780df45ce78e4c9dcccd814fe9a5f1528485
--- /dev/null
+++ b/util/calculateaplusaminusnohfi.m
@@ -0,0 +1,13 @@
+function [APlus, AMinus] = calculateaplusaminusnohfi(A, AFrame, nVers)
+    % For spin 1
+    Ahfi1Tensor = rotatematrixeuangles(diag(A(1, 1:3)), AFrame(1, 1:3));
+    Ahfi1 = squeeze( ...
+        sqrt( sum( (pagemtimes(Ahfi1Tensor', nVers)).^2)));
+    % For spin 2
+    Ahfi2Tensor = rotatematrixeuangles(diag(A(1, 4:6)), AFrame(1, 4:6));
+    Ahfi2 = squeeze( ...
+        sqrt( sum( (pagemtimes(Ahfi2Tensor', nVers)).^2)));
+
+    APlus = (Ahfi1 + Ahfi2)/2;  % MHz
+    AMinus = (Ahfi1 - Ahfi2)/2;  % MHz
+end
\ No newline at end of file
diff --git a/util/creategaxisinhbroadening.m b/util/creategaxisinhbroadening.m
new file mode 100755
index 0000000000000000000000000000000000000000..17266ab7ab135e04ac0b66faea988772649910e9
--- /dev/null
+++ b/util/creategaxisinhbroadening.m
@@ -0,0 +1,11 @@
+function [gax, gInh] = creategaxisinhbroadening(g, glw, dgax)
+% [gax, gInh] = creategaxisinhbroadening(g, glw, dgax)
+% Here glw1 and glw2 are the lwpp, therefore the variance will be
+% lwpp*2
+gax = (g - glw):dgax:(g + glw);
+    
+% Inhomogeneously broadened gaussian distributions
+normTerm = sqrt(2/pi)/glw;
+gInh = normTerm*exp(-2 * (gax - g).^2 ./ glw^2);
+
+end
\ No newline at end of file
diff --git a/util/createthetaphigrid.m b/util/createthetaphigrid.m
new file mode 100755
index 0000000000000000000000000000000000000000..85190b90c08befda1f2f1fbf8676134b45733b19
--- /dev/null
+++ b/util/createthetaphigrid.m
@@ -0,0 +1,13 @@
+function [thetas, phis] = createthetaphigrid(nTheta, nPhi)
+% [thetas, phis] = createthetaphigrid(nTheta, nPhi)
+% 
+% Output thetas (nTheta, 1) and phis (nPhi, 1) in the interval from 0 to pi
+% Note: avoids theta = 0 and theta = pi. Avoids phi = pi.
+    
+thetas = linspace(0, 180, nTheta + 2)*pi/180;
+thetas = thetas(2:end - 1);
+thetas = thetas';
+phis = linspace(0, 180, nPhi + 1)*pi/180;
+phis = phis(1:end - 1);
+end
+
diff --git a/util/dipinteraction.m b/util/dipinteraction.m
new file mode 100644
index 0000000000000000000000000000000000000000..c41d61fb9b583a92c8f77690de8afb91ebfa2ec4
--- /dev/null
+++ b/util/dipinteraction.m
@@ -0,0 +1,8 @@
+function dd = dipinteraction(dip, nVers, zD)
+% dd = dipinteraction(dip, nVers, zD)
+% 
+% Dipolar interaction
+% Makes use of the fact that cos(thetaD) = dotProduct(B0, zD)
+dd = dip*((sum(nVers.*zD)).^2 - 1/3);
+end
+
diff --git a/util/freq2gvalue.m b/util/freq2gvalue.m
new file mode 100755
index 0000000000000000000000000000000000000000..73c12e8729fcba11733b0fc8c5cfdd6182bd2a18
--- /dev/null
+++ b/util/freq2gvalue.m
@@ -0,0 +1,6 @@
+function g = freq2gvalue(B0, freq)
+% g = freq2gvalue(B0, freq)
+%
+% B0 in mT, freq in MHz
+g = planck/bmagn/B0*freq*1e9;
+end
diff --git a/util/gaussianresonancebsweep.m b/util/gaussianresonancebsweep.m
new file mode 100755
index 0000000000000000000000000000000000000000..43a73daaa856270cb231d704a70d480baaaea630
--- /dev/null
+++ b/util/gaussianresonancebsweep.m
@@ -0,0 +1,12 @@
+function y1 = gaussianresonancebsweep(wReson, mwFreq, c, mode)
+    arguments
+        wReson
+        mwFreq  
+        c    (1, 1) double     
+        mode string = "lwpp"
+    end    
+
+    normTerm = sqrt(2/pi)/c;
+    y1 = normTerm*exp(-2 * (wReson - mwFreq).^2 ./ c^2);
+
+end
diff --git a/util/gvalue2freq.m b/util/gvalue2freq.m
new file mode 100755
index 0000000000000000000000000000000000000000..f107ae70fd4bc10f7d9f1e5686a850594d796a2d
--- /dev/null
+++ b/util/gvalue2freq.m
@@ -0,0 +1,6 @@
+function freq = gvalue2freq(B0, g)
+% freq = gvalue2freq(B0, g)
+%
+% B0 in mT, output freq in MHz
+freq = bmagn*B0/planck*g*1e-9;
+end
\ No newline at end of file
diff --git a/util/mixinganglexi.m b/util/mixinganglexi.m
new file mode 100644
index 0000000000000000000000000000000000000000..13357f0dfc414c8f148ca3cf78cd55ab77d5a664
--- /dev/null
+++ b/util/mixinganglexi.m
@@ -0,0 +1,9 @@
+function xi = mixinganglexi(deltaw, JJ, dd)
+%MIXINGANGLEXI Summary of this function goes here
+%   Detailed explanation goes here
+% if size(deltaw) ~= size(dd)
+
+    
+xi = atan( (dd/2 + JJ) ./ deltaw);
+end
+
diff --git a/util/mytrepr.m b/util/mytrepr.m
new file mode 100755
index 0000000000000000000000000000000000000000..de22cc5d3b06d6eab042c9aaf452e1fbf8cea0c3
--- /dev/null
+++ b/util/mytrepr.m
@@ -0,0 +1,7 @@
+function [outputArg1,outputArg2] = mytrepr(inputArg1,inputArg2)
+%MYTREPR Summary of this function goes here
+%   Detailed explanation goes here
+outputArg1 = inputArg1;
+outputArg2 = inputArg2;
+end
+
diff --git a/util/mytreprmf.m b/util/mytreprmf.m
new file mode 100755
index 0000000000000000000000000000000000000000..8b1901477b290ba850c50b5c4d1a9bcf5aeed7f5
--- /dev/null
+++ b/util/mytreprmf.m
@@ -0,0 +1,7 @@
+function [outputArg1,outputArg2] = ytreprmf(inputArg1,inputArg2)
+%YTREPRMF Summary of this function goes here
+%   Detailed explanation goes here
+outputArg1 = inputArg1;
+outputArg2 = inputArg2;
+end
+
diff --git a/util/restrictgaussianfactor.m b/util/restrictgaussianfactor.m
new file mode 100755
index 0000000000000000000000000000000000000000..91c67bc95b96a339bd75f01d9dcb37bca31a35af
--- /dev/null
+++ b/util/restrictgaussianfactor.m
@@ -0,0 +1,18 @@
+function [newMatr, idxs1, idxs2] = restrictgaussianfactor(matr, xx1, xx2)
+% [newMatr, idxs1, idxs2] = restrictgaussianfactor(matr, xx1, xx2)
+    [~, idxMax1] = max(xx1);
+    [~, idxMax2] = max(xx2);
+    [~, idxFwhm1] = min(abs(matr(:, idxMax2) - max(matr(:))/2));
+    idxDxFwhm1 = abs(idxMax1 - idxFwhm1);
+    [~, idxFwhm2] = min(abs(matr(idxMax1, :) - max(matr(:))/2));
+    idxDxFwhm2 = abs(idxMax2 - idxFwhm2);
+    
+    xxFactor = 2;
+    dx1 = round(xxFactor*idxDxFwhm1);
+    dx2 = round(xxFactor*idxDxFwhm2);
+    idxs1 = max(idxMax1 - dx1, 1):...
+            min(idxMax1 + dx1, numel(xx1));
+    idxs2 = max(idxMax2 - dx2, 1):...
+            min(idxMax2 + dx2, numel(xx1));
+    newMatr = matr(idxs1, idxs2);
+end
diff --git a/util/rotatematrixeuangles.m b/util/rotatematrixeuangles.m
new file mode 100755
index 0000000000000000000000000000000000000000..3fcf0bd2a6de43e5a67898e4cdb1bddae6535d89
--- /dev/null
+++ b/util/rotatematrixeuangles.m
@@ -0,0 +1,9 @@
+function newMat = rotatematrixeuangles(mat, euAngles)
+% newMat = rotatematrixeuangles(mat, euAngles)
+% 
+% euAngles are the ones given in the Easyspin convention
+    
+euMatrix = erot(euAngles)';
+newMat = euMatrix*mat*transpose(euMatrix);    
+end
+
diff --git a/zech_gBroadening_leastSquareFit.asv b/zech_gBroadening_leastSquareFit.asv
deleted file mode 100644
index eb9a203f381abaee8aa229dd68f264b0b9386a29..0000000000000000000000000000000000000000
--- a/zech_gBroadening_leastSquareFit.asv
+++ /dev/null
@@ -1,380 +0,0 @@
-%
-clearvars
-addpath(genpath('S:\soft\matlab\'))
-addpath(genpath('/net/storage/gianlum33/soft/matlab/'))
-
-%% Easyspin simulation
-
-% Taken from Easyspin example
-Sys.S = [1/2 1/2];
-Sys.g = [2.0030 2.0026 2.0023; ... % P700+
-         2.0062 2.0051 2.0022];    % A1-
-Sys.gFrame = [-10 -128 -83; ...
-                0    0   0]*pi/180;
-Sys.eeFrame = [0 90 0]*pi/180;  % zD direction is along -x of A1-
-
-Sys.J = (-1/2)*unitconvert(1e-3,'mT->MHz'); % MHz
-Sys.dip = unitconvert(0.170,'mT->MHz')/1.5; % MHz
-Sys.initState = 'singlet';
-
-fieldAxis = linspace(343.635, 347.635, 301);  % GHz
-mwFreq = 9.7;  % GHz
-
-Opt.GridSize = [91 0];
-Opt.GridSymmetry = '';
-
-% Field sweep
-Exp.CenterSweep = [mean(fieldAxis), max(fieldAxis) - min(fieldAxis)];
-Exp.mwFreq = mwFreq;
-Exp.Harmonic = 0;
-Exp.nPoints = numel(fieldAxis);
-
-Sys.lwpp = 0.35;  % mT
-
-ySim = pepper(Sys, Exp, Opt);
-ySim = ySim/max(abs(ySim));
-
-clf
-plot(fieldAxis, ySim)
-
-%% My powder average (only for equivalent nuclei)
-
-mySys.g = Sys.g;
-mySys.gFrame = Sys.gFrame;
-mySys.dip = mt2mhz(-0.170);  % MHz
-mySys.J = mt2mhz(1e-3);  % MHz
-mySys.eeFrame = Sys.eeFrame;
-mySys.nNuc = 3;
-mySys.A = [0, 0, 0, 9, 9.4, 12.8];  % MHz
-mySys.AFrame = [0 0 0 60 -90 0]*pi/180;
-mySys.lw1 = 3.785;  % mT
-mySys.lw1 = 1.5;  % mT
-mySys.lw2 = 0.323;  % mT
-mySys.lw2 = 0.35;  % mT
-% mySys.mwFreq = mwFreq;
-% mySys.x = fieldAxis;
-mySys.nTheta = 20;
-mySys.nPhi = 10;
-
-% tic
-% [myySim, gax, gInh1, gInh2, gax1, gInh11, gax2, gInh22] = mytrepr(mySys);
-
-% myySim = mytrepr(mySys);
-% toc
-
-% hold on
-% plot(fieldAxis, myySim)
-
-% FitOpt.maxTime = 0.1;
-FitOpt.TolFun = 1e-4;
-FitOpt.TolEdgeLength = 1e-4;
-FitOpt.CalculateUncertainties = 0;
-
-% load('S:/projects/zech_psi/data/processed/ZePSI-E-007015.mat');
-% % clf
-% % h = ScrollableAxes();
-% % plot(h, x{2}, x{1}, y');
-% xdata = x{2}/10;  % mT
-% ydata = y(500, :);
-% ydata = ydata/max(abs(ydata));
-% 
-% clf
-% plot(ydata)
-% hold on
-% plot(myySim)
-
-%%
-
-pathFolder = "/net/storage/gianlum33/projects/oop_ciss_calculations/" + ...
-    "data/digitized/";
-pathX = pathFolder + "expData_zech_aStructuralModelFor_xBand.mat";
-pathQ = pathFolder + "expData_zech_aStructuralModelFor_qBand.mat";
-pathW = pathFolder + "expData_zech_aStructuralModelFor_wBand.mat";
-
-importedData = load(pathX);
-xX = importedData.x;
-yX = importedData.y;
-importedData = load(pathQ);
-xQ = importedData.x;
-yQ = importedData.y;
-importedData = load(pathW);
-xW = importedData.x;
-yW = importedData.y;
-
-
-Vary.lw1 = 1;
-Vary.lw2 = 0.3;
-
-ydata = {yX, yQ};
-mySys.mwFreqX = 9.7;
-mySys.mwFreqQ = 34;
-mySys.xX = fieldAxis;
-mySys.xQ = fieldAxis*mySys.mwFreqQ/mySys.mwFreqQ;
-
-tic
-ySim = mytreprXQW(mySys);
-%Fit = 
-% esfit(ydata, @mytreprXQW, {mySys}, {Vary}, FitOpt);
-toc
-%%
-clf
-plot(ydata)
-hold on
-plot(Fit.fit)
-
-ydata = {yX, yQ};
-
-
-%%
-
-function data = mytreprXQW(Sys)
-Sys.mwFreq = Sys.mwFreqX;
-Sys.x = Sys.xX;
-data{1} = mytrepr(Sys);
-Sys.mwFreq = Sys.mwFreqQ;
-Sys.x = Sys.xQ;
-data{2} = mytrepr(Sys);
-% Sys.mwFreq = Sys.mwFreqW;
-% Sys.x = Sys.xW;
-% data{3} = mytrepr(Sys);
-end
-
-% function [ySim, gax, gInh1, gInh2, gax1, gInh11, gax2, gInh22] = mytrepr(Sys)
-function ySim = mytrepr(Sys)
-    fieldAxis = Sys.x;
-    Bmean = mean(fieldAxis);
-    dip = Sys.dip;
-    JJ = Sys.J;
-    mwFreq = Sys.mwFreq;
-    nTheta = Sys.nTheta;
-    nPhi = Sys.nPhi;
-    if isfield(Sys, 'nNuc')
-        nNuc = Sys.nNuc;
-    else
-        nNuc = 0;
-    end
-    nHfiLine = nNuc + 1;
-    
-    % Parameters for g broadening
-    lw1 = mt2mhz(Sys.lw1);
-    lw2 = mt2mhz(Sys.lw2);
-    % The g-factor linewidth
-    glw1 = w2gFunc(Bmean, lw1);
-    glw2 = w2gFunc(Bmean, lw2);
-    % Spacing between g-values
-    dgax1 = glw1 / 20;
-    dgax2 = glw2 / 20;
-    resLw = min(lw1, lw2)*6e-1*1e-3;  % GHz
-    
-    % Grid
-    [thetas, phis] = createthetaphigrid(nTheta, nPhi);
-    nSolidAngle = nTheta*nPhi;
-
-    % Direction of B0
-    nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
-    % Effective g-values
-    g1Tensor = rotatematrix(diag(Sys.g(1, :)), Sys.gFrame(1, :));
-    g1 = sqrt( sum( (g1Tensor*nVers).^2, 1));
-    g2Tensor = rotatematrix(diag(Sys.g(2, :)), Sys.gFrame(2, :));    
-    g2 = sqrt( sum( (g2Tensor*nVers).^2, 1));
-    % Dipolar interaction
-    zD = erot(Sys.eeFrame)*[0, 0, 1]';
-    dd = dipFunc(dip, nVers, zD);
-    
-    if nNuc > 0
-        [APlus, AMinus] = calculateaplusaminusnohfi(...
-            Sys.A, Sys.AFrame, nVers);
-    else
-        APlus = zeros(nSolidAngle, 1);
-        AMinus = zeros(nSolidAngle, 1);
-    end
-    
-    ySim = zeros(numel(fieldAxis), 1);
-    parfor ii = 1:nSolidAngle
-        nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
-
-        %{
-        [gax, gInh1, gInh2] = ...
-            creategaxis(g1(ii), g2(ii), glw1, glw2, dgax2);
-        ngax = numel(gax);
-        % "Probability matrix" of a certain spin interacting with another
-        gaussianFactor = gInh1'*gInh2;
-        gaussianFactor = gaussianFactor/sum(gaussianFactor, 'all');
-        [gaussianFactor, idxs1, idxs2] = restrictgaussianfactor(...
-            gaussianFactor, gInh1, gInh2);
-        gaussianFactor = gaussianFactor(:)';
-
-        gPlus = 1/2*(repmat(gax', [1, ngax]) + repmat(gax, [ngax, 1]));
-        gPlus = gPlus(idxs1, idxs2);
-        gPlus = gPlus(:)';
-        gMinus = 1/2*(repmat(gax', [1, ngax]) - repmat(gax, [ngax, 1]));
-        gMinus = gMinus(idxs1, idxs2);
-        gMinus = gMinus(:)';
-        %}
-       
-        %%{
-        [gax1, gInh1] = creategaxis2(g1(ii), glw1, dgax1);
-        [gax2, gInh2] = creategaxis2(g2(ii), glw2, dgax2);
-        ngax1 = numel(gax1);
-        ngax2 = numel(gax2);
-        
-        gaussianFactor = gInh1'*gInh2;
-        gaussianFactor = gaussianFactor/sum(gaussianFactor, 'all');
-        gaussianFactor = gaussianFactor(:)';
-
-        gPlus = 1/2*(repmat(gax1', [1, ngax2]) + repmat(gax2, [ngax1, 1]));
-        gPlus = gPlus(:)';
-        gMinus = 1/2*(repmat(gax1', [1, ngax2]) - repmat(gax2, [ngax1, 1]));
-        gMinus = gMinus(:)';
-        %}
-        
-        w0_ = g2wFunc(fieldAxis', gPlus);
-        deltaw_ = g2wFunc(fieldAxis', gMinus);
-        sintheta_ = sqrt( nVers(1, ii)^2 + nVers(2, ii)^2 );
-
-        quantNumNuc = -nNuc/2:1:nNuc/2;
-        signJmd = [-1, 1, -1, 1];
-        signOmega = [-1, -1, 1, 1];
-        signIntens = [1, -1, 1, -1];
-        if nNuc > 0
-            pascalMatrix = pascal(nHfiLine);
-            % Antidiag
-            pascalFactor = pascalMatrix(nHfiLine:nHfiLine - 1:end - 1);
-        else
-            pascalFactor = 1;
-        end
-
-        for itrans = 1:4
-            for ihfi = 1:nHfiLine
-                w0__ = w0_ + quantNumNuc(ihfi)*APlus(ii);
-                deltaw__ = deltaw_ + quantNumNuc(ihfi)*AMinus(ii);
-                Omega__ = hypot(deltaw__, JJ+dd(ii)/2);
-                wReson = w0__ + signJmd(itrans)*(JJ - dd(ii)) + ...
-                    signOmega(itrans)*Omega__;
-
-                intensityReson = signIntens(itrans)*1/8*...
-                    (deltaw__.^2)./(Omega__.^2);
-                trSignal__ = gaussianbs(wReson*1e-3, mwFreq, resLw, "lwpp");
-                trSignal__ = intensityReson.*trSignal__*...
-                    pascalFactor(ihfi).*gaussianFactor;
-                ySim = ySim + sum(trSignal__, 2)*sintheta_;
-            end
-        end
-        %}
-    end
-    %}
-    ySim = ySim/max(abs(ySim));
-
-end
-
-function freq = g2wFunc(B0, g)
-    % Expected input: B0 in mT
-    % Output: frequency nu in MHz
-    freq = bmagn*B0/planck*g*1e-9;
-end
-
-function g = w2gFunc(B0, freq)
-    % Expected input: B0 in mT
-    % Output: frequency nu in MHz
-    g = planck/bmagn/B0*freq*1e9;
-end
-
-function dd = dipFunc(dip, nVers, zD)
-    % Dipolar interaction
-    % Makes use of the fact that cos(thetaD) = dotProduct(B0, zD)
-    % Expected input:
-    %   dip:    1 x 1
-    %   nVers:  3 x nTheta x nPhi
-    %   zD:     3 x 1
-    dd = dip*((sum(nVers.*zD)).^2 - 1/3);
-end
-
-function [thetas, phis] = createthetaphigrid(nTheta, nPhi)
-    
-    thetas = linspace(0, 180, nTheta + 2)*pi/180;
-    thetas = thetas(2:end - 1);
-    thetas = thetas';
-    phis = linspace(0, 180, nPhi + 1)*pi/180;
-    phis = phis(1:end - 1);
-    
-end
-
-function newMat = rotatematrix(mat, euAngles)
-    % newMat = R*mat*transpose(R)
-    % euAngles are the ones given in the Easyspin convention
-    
-    euMatrix = erot(euAngles)';
-    newMat = euMatrix*mat*transpose(euMatrix);
-    
-end
-
-function [APlus, AMinus] = calculateaplusaminusnohfi(A, AFrame, nVers)
-    % For spin 1
-    Ahfi1Tensor = rotatematrix(diag(A(1, 1:3)), AFrame(1, 1:3));
-    Ahfi1 = squeeze( ...
-        sqrt( sum( (pagemtimes(Ahfi1Tensor', nVers)).^2)));
-    % For spin 2
-    Ahfi2Tensor = rotatematrix(diag(A(1, 4:6)), AFrame(1, 4:6));
-    Ahfi2 = squeeze( ...
-        sqrt( sum( (pagemtimes(Ahfi2Tensor', nVers)).^2)));
-
-    APlus = (Ahfi1 + Ahfi2)/2;  % MHz
-    AMinus = (Ahfi1 - Ahfi2)/2;  % MHz
-end
-
-function [gax, gInh1, gInh2] = creategaxis(g1, g2, glw1, glw2, dgax)
-    % Here glw1 and glw2 are the lwpp, therefore the variance will be
-    % lwpp*2
-    xxFactor = 1;
-    xmin = min([g1 - xxFactor*glw1, g2 - xxFactor*glw2]);
-    xmax = max([g1 + xxFactor*glw1, g2 + xxFactor*glw2]);
-    gax = xmin:dgax:xmax;
-    
-    % Inhomogeneously broadened gaussian distributions
-    gInh1 = gaussian(gax, g1, glw1);
-    gInh2 = gaussian(gax, g2, glw2);
-end
-
-function [gax, gInh] = creategaxis2(g, glw, dgax)
-    % Here glw1 and glw2 are the lwpp, therefore the variance will be
-    % lwpp*2
-    gax = (g - glw):dgax:(g + glw);
-    
-    % Inhomogeneously broadened gaussian distributions
-    normTerm = sqrt(2/pi)/glw;
-    gInh = normTerm*exp(-2 * (gax - g).^2 ./ glw^2);
-    gInh = gaussian(gax, g, glw);
-
-
-end
-
-function [newMatr, idxs1, idxs2] = restrictgaussianfactor(matr, xx1, xx2)
-    [~, idxMax1] = max(xx1);
-    [~, idxMax2] = max(xx2);
-    [~, idxFwhm1] = min(abs(matr(:, idxMax2) - max(matr(:))/2));
-    idxDxFwhm1 = abs(idxMax1 - idxFwhm1);
-    [~, idxFwhm2] = min(abs(matr(idxMax1, :) - max(matr(:))/2));
-    idxDxFwhm2 = abs(idxMax2 - idxFwhm2);
-    
-    xxFactor = 2;
-    dx1 = round(xxFactor*idxDxFwhm1);
-    dx2 = round(xxFactor*idxDxFwhm2);
-    idxs1 = max(idxMax1 - dx1, 1):...
-            min(idxMax1 + dx1, numel(xx1));
-    idxs2 = max(idxMax2 - dx2, 1):...
-            min(idxMax2 + dx2, numel(xx1));
-    newMatr = matr(idxs1, idxs2);
-end
-
-function y1 = gaussianbs(wReson, mwFreq, c, mode)
-    arguments
-        wReson
-        mwFreq  
-        c    (1, 1) double     
-        mode string = "lwpp"
-    end    
-
-    normTerm = sqrt(2/pi)/c;
-    y1 = normTerm*exp(-2 * (wReson - mwFreq).^2 ./ c^2);
-
-end
diff --git a/zech_gBroadening_leastSquareFit.m b/zech_gBroadening_leastSquareFit.m
index 173851cafbcf6885a4906c9a7abfb7a106580bc8..92b4f229a52d6cc621793a42d58984770ae0bd7b 100755
--- a/zech_gBroadening_leastSquareFit.m
+++ b/zech_gBroadening_leastSquareFit.m
@@ -2,13 +2,14 @@
 clearvars
 addpath(genpath('S:\soft\matlab\'))
 addpath(genpath('/net/storage/gianlum33/soft/matlab/'))
+addpath('S:\projects\oop_ciss_calculations\util\')
 
 %% Easyspin simulation
 
 % Taken from Easyspin example
 Sys.S = [1/2 1/2];
-Sys.g = [2.0030 2.0026 2.0023; ... % P700+
-         2.0062 2.0051 2.0022];    % A1-
+Sys.g = [2.00308 2.00264 2.00226; ... % P700+
+         2.00622 2.00507 2.00218];    % A1-
 Sys.gFrame = [-10 -128 -83; ...
                 0    0   0]*pi/180;
 Sys.eeFrame = [0 90 0]*pi/180;  % zD direction is along -x of A1-
@@ -37,6 +38,38 @@ ySim = ySim/max(abs(ySim));
 clf
 plot(fieldAxis, ySim)
 
+%%
+
+%pathFolder = "/net/storage/gianlum33/";
+pathFolder = "S:\";
+pathFolder = pathFolder + "projects/oop_ciss_calculations/data/digitized/";
+pathX = pathFolder + "expData_zech_aStructuralModelFor_xBandDeut.mat";
+pathQ = pathFolder + "expData_zech_aStructuralModelFor_qBandDeut.mat";
+pathW = pathFolder + "expData_zech_aStructuralModelFor_wBandDeut.mat";
+
+importedData = load(pathX);
+xdataXdeut = importedData.x;
+ydataXdeut = importedData.y;
+importedData = load(pathQ);
+xdataQdeut = importedData.x;
+ydataQdeut = importedData.y;
+ydataQdeut = ydataQdeut - (ydataQdeut(1) + ydataQdeut(end))/2;
+importedData = load(pathW);
+xdataWdeut = importedData.x;
+ydataWdeut = importedData.y;
+
+importedData = load('S:\projects\zech_psi\data\processed\ZePSI-E-007015.mat');
+% clf
+% h = ScrollableAxes();
+% plot(h, x{2}, x{1}, y');
+xdataX = importedData.x{2}'/10;  % mT
+ydataX = importedData.y(815, :);
+ydataX = ydataX/max(abs(ydataX));
+pathQ2 = pathFolder + "expData_zech_aStructuralModelFor_qBand.mat";
+importedData = load(pathQ2);
+xdataQ = importedData.x;
+ydataQ = importedData.y;
+
 %% My powder average (only for equivalent nuclei)
 
 mySys.g = Sys.g;
@@ -47,58 +80,69 @@ mySys.eeFrame = Sys.eeFrame;
 mySys.nNuc = 3;
 mySys.A = [0, 0, 0, 9, 9.4, 12.8];  % MHz
 mySys.AFrame = [0 0 0 60 -90 0]*pi/180;
-mySys.lw1 = 3.785;  % mT
-mySys.lw1 = 1.5;  % mT
-mySys.lw2 = 0.323;  % mT
-mySys.lw2 = 0.35;  % mT
-mySys.mwFreq = mwFreq;
-mySys.x = fieldAxis;
-mySys.nTheta = 20;
-mySys.nPhi = 10;
-
-% tic
-% [myySim, gax, gInh1, gInh2, gax1, gInh11, gax2, gInh22] = mytrepr(mySys);
-
-myySim = mytrepr(mySys);
-% toc
-
-% hold on
-% plot(fieldAxis, myySim)
+% mySys.lw1 = 0.31;  % mT
+mySys.lw1 = 0.7499;  % mT
+% mySys.lw2 = 0.25;  % mT
+mySys.lw2 = 0.3190;  % mT
 
 % FitOpt.maxTime = 0.1;
-FitOpt.TolFun = 1e-4;
-FitOpt.TolEdgeLength = 1e-4;
+% FitOpt.TolFun = 1e-4;
+% FitOpt.TolEdgeLength = 1e-5;
 FitOpt.CalculateUncertainties = 0;
 
-load('S:/projects/zech_psi/data/processed/ZePSI-E-007015.mat');
-% clf
-% h = ScrollableAxes();
-% plot(h, x{2}, x{1}, y');
-xdata = x{2}/10;  % mT
-ydata = y(500, :);
-ydata = ydata/max(abs(ydata));
+Vary.lw1 = mySys.lw1 - 0.05;
+Vary.lw2 = mySys.lw2 - 0.05;
 
-clf
-plot(ydata)
-hold on
-plot(myySim)
-
-%%
-
-Vary.lw1 = 1;
-Vary.lw2 = 0.3;
+ydata = {ydataX, ydataQ};
+mySys.mwFreq_MF = {9.7, 34};
+mySys.x_MF = {xdataX + 5.5, xdataQ}; %xW - 3.95};
+mySys.nTheta_MF = {91, 91}; %, 50};
+mySys.nPhi_MF = {45, 45}; %, 20};
+mySys.nSamplegInh1_MF = {30, 30};
+mySys.nSamplegInh2_MF = {30, 30};
+mySys.coeffResLw_MF = {0.1, 0.2};
 
 tic
-% Fit = esfit(ydata, @mytrepr, {mySys}, {Vary}, FitOpt);
+% ySim = mytreprmf(mySys);
+Fit = esfit(ydata, @mytreprmf, {mySys}, {Vary}, FitOpt);
 toc
 
-clf
-plot(ydata)
-hold on
-plot(Fit.fit)
+tiledlayout('flow', 'TileSpacing', 'compact', 'Padding', 'compact')
+for ii = 1:numel(ydata)
+    nexttile
+    plot(ydata{ii})
+    hold on
+    plot(Fit.fit{ii})
+%     plot(ySim{ii})
+%     plot(rescaledata(ySim{ii}, ydata{ii}, 'lsq'))
+    xlim(setaxlim(1:numel(ydata{ii})))
+    ylim(setaxlim(ydata{ii}, 1.05))
+end
+
+% tic
+% ydata = {yX, yQ, yW};
+% Fit = esfit(ydata, @mytreprmf, {mySys}, {Vary}, FitOpt);
 
+%%
+ySim0 = mytreprmf(mySys);
 %%
 
+function data = mytreprmf(Sys)
+    
+    nSpc = numel(Sys.mwFreq_MF);
+    fields = fieldnames(Sys);
+    for ispc = 1:nSpc
+        for ifield = 1:numel(fields)
+            f = fields{ifield};
+            if endsWith(f, '_MF')
+                f_ = f(1:end - 3);
+                Sys.(f_) = Sys.(f){ispc};
+            end
+        end
+        data{ispc} = mytrepr(Sys);
+    end
+end
+
 % function [ySim, gax, gInh1, gInh2, gax1, gInh11, gax2, gInh22] = mytrepr(Sys)
 function ySim = mytrepr(Sys)
     fieldAxis = Sys.x;
@@ -119,12 +163,12 @@ function ySim = mytrepr(Sys)
     lw1 = mt2mhz(Sys.lw1);
     lw2 = mt2mhz(Sys.lw2);
     % The g-factor linewidth
-    glw1 = w2gFunc(Bmean, lw1);
-    glw2 = w2gFunc(Bmean, lw2);
+    glw1 = freq2gvalue(Bmean, lw1);
+    glw2 = freq2gvalue(Bmean, lw2);
     % Spacing between g-values
-    dgax1 = glw1 / 20;
-    dgax2 = glw2 / 20;
-    resLw = min(lw1, lw2)*6e-1*1e-3;  % GHz
+    dgax1 = glw1 / Sys.nSamplegInh1;
+    dgax2 = glw2 / Sys.nSamplegInh2;
+    resLw = min(lw1, lw2)*Sys.coeffResLw*1e-3;  % GHz
     
     % Grid
     [thetas, phis] = createthetaphigrid(nTheta, nPhi);
@@ -133,13 +177,13 @@ function ySim = mytrepr(Sys)
     % Direction of B0
     nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
     % Effective g-values
-    g1Tensor = rotatematrix(diag(Sys.g(1, :)), Sys.gFrame(1, :));
+    g1Tensor = rotatematrixeuangles(diag(Sys.g(1, :)), Sys.gFrame(1, :));
     g1 = sqrt( sum( (g1Tensor*nVers).^2, 1));
-    g2Tensor = rotatematrix(diag(Sys.g(2, :)), Sys.gFrame(2, :));    
+    g2Tensor = rotatematrixeuangles(diag(Sys.g(2, :)), Sys.gFrame(2, :));    
     g2 = sqrt( sum( (g2Tensor*nVers).^2, 1));
     % Dipolar interaction
     zD = erot(Sys.eeFrame)*[0, 0, 1]';
-    dd = dipFunc(dip, nVers, zD);
+    dd = dipinteraction(dip, nVers, zD);
     
     if nNuc > 0
         [APlus, AMinus] = calculateaplusaminusnohfi(...
@@ -152,29 +196,9 @@ function ySim = mytrepr(Sys)
     ySim = zeros(numel(fieldAxis), 1);
     parfor ii = 1:nSolidAngle
         nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
-
-        %{
-        [gax, gInh1, gInh2] = ...
-            creategaxis(g1(ii), g2(ii), glw1, glw2, dgax2);
-        ngax = numel(gax);
-        % "Probability matrix" of a certain spin interacting with another
-        gaussianFactor = gInh1'*gInh2;
-        gaussianFactor = gaussianFactor/sum(gaussianFactor, 'all');
-        [gaussianFactor, idxs1, idxs2] = restrictgaussianfactor(...
-            gaussianFactor, gInh1, gInh2);
-        gaussianFactor = gaussianFactor(:)';
-
-        gPlus = 1/2*(repmat(gax', [1, ngax]) + repmat(gax, [ngax, 1]));
-        gPlus = gPlus(idxs1, idxs2);
-        gPlus = gPlus(:)';
-        gMinus = 1/2*(repmat(gax', [1, ngax]) - repmat(gax, [ngax, 1]));
-        gMinus = gMinus(idxs1, idxs2);
-        gMinus = gMinus(:)';
-        %}
-       
-        %%{
-        [gax1, gInh1] = creategaxis2(g1(ii), glw1, dgax1);
-        [gax2, gInh2] = creategaxis2(g2(ii), glw2, dgax2);
+        
+        [gax1, gInh1] = creategaxisinhbroadening(g1(ii), glw1, dgax1);
+        [gax2, gInh2] = creategaxisinhbroadening(g2(ii), glw2, dgax2);
         ngax1 = numel(gax1);
         ngax2 = numel(gax2);
         
@@ -188,8 +212,8 @@ function ySim = mytrepr(Sys)
         gMinus = gMinus(:)';
         %}
         
-        w0_ = g2wFunc(fieldAxis', gPlus);
-        deltaw_ = g2wFunc(fieldAxis', gMinus);
+        w0_ = gvalue2freq(fieldAxis', gPlus);
+        deltaw_ = gvalue2freq(fieldAxis', gMinus);
         sintheta_ = sqrt( nVers(1, ii)^2 + nVers(2, ii)^2 );
 
         quantNumNuc = -nNuc/2:1:nNuc/2;
@@ -214,7 +238,8 @@ function ySim = mytrepr(Sys)
 
                 intensityReson = signIntens(itrans)*1/8*...
                     (deltaw__.^2)./(Omega__.^2);
-                trSignal__ = gaussianbs(wReson*1e-3, mwFreq, resLw, "lwpp");
+                trSignal__ = gaussianresonancebsweep(...
+                    wReson*1e-3, mwFreq, resLw, "lwpp");
                 trSignal__ = intensityReson.*trSignal__*...
                     pascalFactor(ihfi).*gaussianFactor;
                 ySim = ySim + sum(trSignal__, 2)*sintheta_;
@@ -226,115 +251,3 @@ function ySim = mytrepr(Sys)
     ySim = ySim/max(abs(ySim));
 
 end
-
-function freq = g2wFunc(B0, g)
-    % Expected input: B0 in mT
-    % Output: frequency nu in MHz
-    freq = bmagn*B0/planck*g*1e-9;
-end
-
-function g = w2gFunc(B0, freq)
-    % Expected input: B0 in mT
-    % Output: frequency nu in MHz
-    g = planck/bmagn/B0*freq*1e9;
-end
-
-function dd = dipFunc(dip, nVers, zD)
-    % Dipolar interaction
-    % Makes use of the fact that cos(thetaD) = dotProduct(B0, zD)
-    % Expected input:
-    %   dip:    1 x 1
-    %   nVers:  3 x nTheta x nPhi
-    %   zD:     3 x 1
-    dd = dip*((sum(nVers.*zD)).^2 - 1/3);
-end
-
-function [thetas, phis] = createthetaphigrid(nTheta, nPhi)
-    
-    thetas = linspace(0, 180, nTheta + 2)*pi/180;
-    thetas = thetas(2:end - 1);
-    thetas = thetas';
-    phis = linspace(0, 180, nPhi + 1)*pi/180;
-    phis = phis(1:end - 1);
-    
-end
-
-function newMat = rotatematrix(mat, euAngles)
-    % newMat = R*mat*transpose(R)
-    % euAngles are the ones given in the Easyspin convention
-    
-    euMatrix = erot(euAngles)';
-    newMat = euMatrix*mat*transpose(euMatrix);
-    
-end
-
-function [APlus, AMinus] = calculateaplusaminusnohfi(A, AFrame, nVers)
-    % For spin 1
-    Ahfi1Tensor = rotatematrix(diag(A(1, 1:3)), AFrame(1, 1:3));
-    Ahfi1 = squeeze( ...
-        sqrt( sum( (pagemtimes(Ahfi1Tensor', nVers)).^2)));
-    % For spin 2
-    Ahfi2Tensor = rotatematrix(diag(A(1, 4:6)), AFrame(1, 4:6));
-    Ahfi2 = squeeze( ...
-        sqrt( sum( (pagemtimes(Ahfi2Tensor', nVers)).^2)));
-
-    APlus = (Ahfi1 + Ahfi2)/2;  % MHz
-    AMinus = (Ahfi1 - Ahfi2)/2;  % MHz
-end
-
-function [gax, gInh1, gInh2] = creategaxis(g1, g2, glw1, glw2, dgax)
-    % Here glw1 and glw2 are the lwpp, therefore the variance will be
-    % lwpp*2
-    xxFactor = 1;
-    xmin = min([g1 - xxFactor*glw1, g2 - xxFactor*glw2]);
-    xmax = max([g1 + xxFactor*glw1, g2 + xxFactor*glw2]);
-    gax = xmin:dgax:xmax;
-    
-    % Inhomogeneously broadened gaussian distributions
-    gInh1 = gaussian(gax, g1, glw1);
-    gInh2 = gaussian(gax, g2, glw2);
-end
-
-function [gax, gInh] = creategaxis2(g, glw, dgax)
-    % Here glw1 and glw2 are the lwpp, therefore the variance will be
-    % lwpp*2
-    gax = (g - glw):dgax:(g + glw);
-    
-    % Inhomogeneously broadened gaussian distributions
-    normTerm = sqrt(2/pi)/glw;
-    gInh = normTerm*exp(-2 * (gax - g).^2 ./ glw^2);
-    gInh = gaussian(gax, g, glw);
-
-
-end
-
-function [newMatr, idxs1, idxs2] = restrictgaussianfactor(matr, xx1, xx2)
-    [~, idxMax1] = max(xx1);
-    [~, idxMax2] = max(xx2);
-    [~, idxFwhm1] = min(abs(matr(:, idxMax2) - max(matr(:))/2));
-    idxDxFwhm1 = abs(idxMax1 - idxFwhm1);
-    [~, idxFwhm2] = min(abs(matr(idxMax1, :) - max(matr(:))/2));
-    idxDxFwhm2 = abs(idxMax2 - idxFwhm2);
-    
-    xxFactor = 2;
-    dx1 = round(xxFactor*idxDxFwhm1);
-    dx2 = round(xxFactor*idxDxFwhm2);
-    idxs1 = max(idxMax1 - dx1, 1):...
-            min(idxMax1 + dx1, numel(xx1));
-    idxs2 = max(idxMax2 - dx2, 1):...
-            min(idxMax2 + dx2, numel(xx1));
-    newMatr = matr(idxs1, idxs2);
-end
-
-function y1 = gaussianbs(wReson, mwFreq, c, mode)
-    arguments
-        wReson
-        mwFreq  
-        c    (1, 1) double     
-        mode string = "lwpp"
-    end    
-
-    normTerm = sqrt(2/pi)/c;
-    y1 = normTerm*exp(-2 * (wReson - mwFreq).^2 ./ c^2);
-
-end
diff --git a/zech_psiOopEseem_powderAverage_inhBroadening.m b/zech_psiOopEseem_powderAverage_inhBroadening.m
index 269ac6ee49518b40a54294192d9c129eeb9c899b..91557d4c151dc1f4da36bec86ca8d48d321cf058 100755
--- a/zech_psiOopEseem_powderAverage_inhBroadening.m
+++ b/zech_psiOopEseem_powderAverage_inhBroadening.m
@@ -2,13 +2,15 @@
 clearvars
 addpath(genpath('S:\soft\matlab\'))
 addpath(genpath('/net/storage/gianlum33/soft/matlab/'))
+addpath(genpath('/net/storage/gianlum33/projects/oop_ciss_calculations/util/'))
+addpath(genpath('S:\projects/oop_ciss_calculations/util/'))
 
 %%
 
 % Import
 % cd('/net/storage/gianlum33/projects/oop_ciss_calculations/')
-expName = 'data/extracted/zech_p46_oopEseem_expData.csv';
-fitName = 'data/extracted/zech_p46_oopEseem_fit.csv';
+expName = 'data/digitized/zech_p46_oopEseem_expData.csv';
+fitName = 'data/digitized/zech_p46_oopEseem_fit.csv';
 
 importedData = readtable(expName);
 x = importedData{:, 1}*pi/180;
@@ -26,10 +28,6 @@ p0Timmel = 41*pi/180;
 initFit = rescaledata(crystalEseemZech(p0Z, xx), 'maxabs');
 expectFit = rescaledata(crystalEseemZech(p0Timmel, xx), 'maxabs');
 
-crystalEseem = @(p, beta) -(...
-    1/2 * sin(2*beta) .* cos(p).^4 + ...
-    1/4 * sin(beta) .* sin(2*p).^2);  % p = 2alpha
-
 p0B = pi/2 - 2*p0Z;  % xi_Bittl = pi/2 - 2*alpha_Zech
 initFit2 = rescaledata(crystalEseem(p0B, xx), 'maxabs');
 
@@ -42,70 +40,15 @@ plot(xx*180/pi, initFit2)
 plot(xx*180/pi, expectFit)
 % esfit()
 
-%%
-
-for ii = 1:4
-    loadPath = append("powderAverage_inhBroadening_glw_0", string(ii), ".mat");
-    sim{ii} = load(loadPath);
-end
-
 %% System definition
- 
-% Taken from Easyspin example
-clear('Sys', 'Exp', 'Vary', 'VaryExp')
 
-Sys.S = [1/2 1/2];
-Sys.g = [2.0030 2.0026 2.0023; ... % P700+
+Sys0.S = [1/2 1/2];
+Sys0.g = [2.0030 2.0026 2.0023; ... % P700+
          2.0062 2.0051 2.0022];    % A1-
-Sys.gFrame = [-10 -128 -83; ...
+Sys0.gFrame = [-10 -128 -83; ...
                 0    0   0]*pi/180;
-Sys.eeFrame = [0 90 0]*pi/180;  % zD direction is along -x of A1-
-
-% Factor 1/1.5 coming from different definition of spin Hamiltonian?
-% Sys.J = unitconvert(1e-3,'mT->MHz')/1.5; % MHz
-% Sys.lw = mt2mhz(0.35);  % MHz
-% Sys.lw = mhz2mt(11);  % MHz
-% Sys.initState = 'singlet';
-
-% nNuc = 3;
-% Sys.Nucs = '1H';
-% Sys.Nucs = repmat(append(Sys.Nucs, ', '), [1, nNuc]);
-% Sys.Nucs = Sys.Nucs(1:end - 2);
-% Sys.A = [zeros(1, 3), 9, 9, 12.8];
-% Sys.A = repmat(Sys.A, [nNuc, 1]);
-% Sys.AFrame = [0 0 0 -60 90 0]*pi/180;
-% Sys.AFrame = repmat(Sys.AFrame, [nNuc, 1]);
-
-B0 = 345.9;  % mT
-mwFreq = 9.7;
-
-%% Functions
-% Expected input: B0 in mT
-% Output: frequency nu in MHz
-g2wFunc = @(B0, g) bmagn*B0/planck*g*1e-9;
-
-% Expected input: B0 in mT
-% Output: frequency nu in MHz
-w2gFunc = @(B0, freq) planck/bmagn/B0*freq*1e9;
-
-% Expected input: deltaw in MHz, J in MHz, d in MHz
-% Output: Omega in MHz
-OmegaFunc = @(deltaw, J, d) sqrt(deltaw.^2 + (J + d/2).^2);
-
-% Dipolar interaction
-% Makes use of the fact that cos(thetaD) = dotProduct(B0, zD)
-% Expected input:
-%   dip:    1 x 1
-%   nVers:  3 x nTheta x nPhi
-%   zD:     3 x 1
-dipFunc = @(dip, nVers, zD) dip*((sum(nVers.*zD)).^2 - 1/3);
-
-% Mixing angle, p = [dd, JJ, deltaw] in [MHz, MHz, MHz]
-xiFunc = @(dd, JJ, deltaw) atan( (dd/2 + JJ) ./ deltaw);
-alphaFunc = @(dd, JJ, deltaw) 1/2*atan( deltaw ./ (JJ + dd/2));
+Sys0.eeFrame = [0 90 0]*pi/180;  % zD direction is along -x of A1-
 
-
-%% Calculation without inhomogenous broadened linewidth
 % tau = 0.;  % us
 
 % Assume finite bandwidth of the excitation pulse
@@ -114,50 +57,486 @@ alphaFunc = @(dd, JJ, deltaw) 1/2*atan( deltaw ./ (JJ + dd/2));
 % gPulsePosition = planck*mwFreq/bmagn/B0;
 % excitRange = [-1/2, +1/2]*gPulseBw + gPulsePosition;
 
-dip = - mt2mhz(0.170);
-JJ = mt2mhz(0.001);
-% Theta, phi grid
-nTheta = 91;
-nPhi = 91;
-thetas = linspace(0, 180, nTheta)*pi/180;
-thetas = thetas';
-phis = linspace(0, 180, nPhi)*pi/180;
-
-tic
-
-% Direction of B0
-nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
-% Effective g-values
-euMatrixg1 = erot(Sys.gFrame(1, :))';
-g1Tensor = euMatrixg1*diag(Sys.g(1, :))*euMatrixg1';
-g1 = sqrt( sum( (g1Tensor*nVers).^2, 1));
-euMatrixg2 = erot(Sys.gFrame(2, :))';
-g2Tensor = euMatrixg2*diag(Sys.g(2, :))*euMatrixg2';
-g2 = sqrt( sum( (g2Tensor*nVers).^2, 1));
-% Dipolar interaction
-zD = erot(Sys.eeFrame)*[0, 0, 1]';
-dd = dipFunc(dip, nVers, zD);
+Sys.g = Sys0.g;
+Sys.gFrame = Sys0.gFrame;
+Sys.dip = mt2mhz(-0.170);  % MHz
+Sys.J = mt2mhz(1e-3);  % MHz
+Sys.eeFrame = Sys0.eeFrame;
+Sys.nNuc = 0;
+Sys.A = [0, 0, 0, 9, 9.4, 12.8];  % MHz
+Sys.AFrame = [0 0 0 60 -90 0]*pi/180;
+
+Sys.mwFreq = 9.7;
+Sys.x = linspace(344.5, 347, 301);  % mT
+Sys.turningAngleAxis = xx;
+Sys.nTheta = 90; %, 50};
+Sys.nPhi = 45; %, 20};
+Sys.lw1 = 0.5;  % mT
+Sys.lw2 = 0.5;  % mT
+Sys.nSamplegInh1 = 100;
+Sys.nSamplegInh2 = 100;
 
-w0 = g2wFunc(B0, (g1 + g2)/2);  % MHz
-deltaw = g2wFunc(B0, (g1 - g2)/2);  % MHz
-Omega = OmegaFunc(deltaw, JJ, dd);  % MHz
+%%
 
-% Mixing angles
-xiNoLw = xiFunc(dd, JJ, deltaw);
-% Signal
-signalNoLw = crystalEseem(xiNoLw, xx);
+[a0, b0] = oopEseemVsBeta(Sys, 0);
+tic
+[a1, b1] = oopEseemVsBeta(Sys, 1);
 toc
 tic
-% Average over all the solid angles with proper normalization
-solidAngleWeight = sin(thetas)/sum(sin(thetas)*ones(1, nPhi), 'all');
-xiNoLw = reshape(xiNoLw, [nTheta, nPhi]);
-xiMeanNoLw = sum(solidAngleWeight.*abs(xiNoLw), 'all');
-signalNoLw = reshape(signalNoLw, [size(xx), nTheta, nPhi]);
-signalPowderNoLw = sum(squeeze(sum(solidAngleWeight'.*signalNoLw, 3)), 2);
+[a2, b2] = oopEseemVsBeta(Sys, 2);
 toc
 
 %%
 
+aa0 = averageoversolidangle(a0, Sys.nTheta, Sys.nPhi, 2);
+aa1 = averageoversolidangle(a1, Sys.nTheta, Sys.nPhi, 2);
+aa2 = averageoversolidangle(a2, Sys.nTheta, Sys.nPhi, 2);
+bb0 = averageoversolidangle(abs(b0), Sys.nTheta, Sys.nPhi, 2);
+bb1 = averageoversolidangle(abs(b1), Sys.nTheta, Sys.nPhi, 2);
+bb2 = averageoversolidangle(abs(b2), Sys.nTheta, Sys.nPhi, 2);
+% sum(abs(a1(:) - a2(:)))
+% sum(abs(b1 - b2))
+clf
+plot(xx*180/pi, rescaledata(aa0, 'maxabs'))
+hold on
+plot(xx*180/pi, rescaledata(aa1, 'maxabs'), 'o')
+plot(xx*180/pi, rescaledata(aa2, 'maxabs'), 'x')
+disp("xiMean0 = " + string(bb0*180/pi) + newline + ...
+    "xiMean1 = " + string(bb1*180/pi) + newline + ...
+    "xiMean2 = " + string(bb2*180/pi))
+
+%%
+xplot = linspace(0, 13, 1000);
+% tiledlayout('flow', 'TileSpacing', 'compact', 'Padding', 'compact')
+% nexxtile
+
+clf
+plot(xplot, abs(mixinganglexi(xplot', Sys.J, ddd(1))), 'o')
+hold on
+plot(xplot, abs(mixinganglexi(xplot', Sys.J, ddd(2))), 'o')
+% plot(xplot, abs(mixinganglexi(xplot', Sys.J, ddd(3))), 'o')
+% plot(xplot, abs(mixinganglexi(xplot', Sys.J, ddd(4))), 'o')
+
+clf
+disp("nTheta = " + string(Sys.nTheta))
+for ith = 3 %1:Sys.nTheta
+    plot(xplot, abs(mixinganglexi(xplot', Sys.J, ddd(ith)))*180/pi, 'o')
+    hold on
+    switch ith
+        case 1
+            color = 'k';
+        case 2
+            color = 'b';
+    end
+    for ihfi = 1:(Sys.nNuc + 1)
+        switch ihfi
+            case 1
+                lstyle = '--';
+            case 2
+                lstyle = '-';
+            case 3
+                lstyle = '-.';
+        end
+        xline(abs(domeg(ith, ihfi)), ...
+            'Color', color, 'LineStyle', lstyle)
+        yline(abs(mixinganglexi(domeg(ith, ihfi), Sys.J, ddd(ith)))*180/pi, ...
+            'Color', color, 'LineStyle', lstyle)
+    end
+    disp("xi central = " + string(xiii(ith, 2)*180/pi) + ...
+        ", xi mean = " + string(mean(abs(xiii(ith, :)))*180/pi))
+end
+
+% Sys.nNuc = 0;
+% [oopNoLw, xiNoLw] = oopEseemVsBeta(Sys);
+% xiMeanNoLw = averageoversolidangle(abs(xiNoLw), Sys.nTheta, Sys.nPhi, 2);
+% oopPowderNoLw = averageoversolidangle(oopNoLw, Sys.nTheta, Sys.nPhi, 2);
+% xiNoLwPlot = reshape(xiNoLw, [Sys.nTheta, Sys.nPhi])*180/pi;
+    
+%%
+
+Sys.lw1 = 0.01;  % mT
+Sys.lw2 = 0.01;  % mT
+Sys.nSamplegInh1 = 10;
+Sys.nSamplegInh2 = 10;
+Sys.nTheta = 3;
+Sys.nPhi = 1;
+Sys.nNuc = 0;
+[sigsig, xixi] = oopEseemVsBeta(Sys, true);
+
+%%
+
+Sys.nTheta = 90;
+Sys.nPhi = 45;
+wb = waitbar(0, 'Hi');
+nnNuc = 2000;
+nNucs = 1:nnNuc;
+for inNuc = 1:nnNuc
+    waitbar(inNuc/nnNuc, wb, sprintf('%d out of %d', inNuc, nnNuc))
+    Sys.nNuc = nNucs(inNuc);
+    [oopNoLwa{inNuc}, xiNoLwa{inNuc}] = oopEseemVsBeta(Sys);
+    xiMeanNoLwa(inNuc) = averageoversolidangle(abs(xiNoLwa{inNuc}), Sys.nTheta, Sys.nPhi, 2);
+    oopPowderNoLwa{inNuc} = averageoversolidangle(oopNoLwa{inNuc}, Sys.nTheta, Sys.nPhi, 2);
+    xiNoLwPlota{inNuc} = reshape(xiNoLwa{inNuc}, [Sys.nTheta, Sys.nPhi])*180/pi;
+end
+
+%%
+
+xplot = [0, nNucs(1:222)];
+yplot = [xiMeanNoLw, xiMeanNoLwa];
+clf
+plot(xplot, yplot)
+
+figure(2)
+tiledlayout('flow', 'TileSpacing', 'compact', 'Padding', 'compact')
+for ii = 1:9
+    nexttile
+    if ii == 1
+        imagesc(abs(xiNoLwPlot))
+        colorbar
+        colormap(viridis())
+    else
+        imagesc(abs(xiNoLwPlota{ii}))
+        colorbar
+        colormap(viridis())
+    end
+    title(ii - 1)
+end
+
+%%
+
+cmappa = viridis(10);
+figure(3)
+clf
+plot(xx*180/pi, rescaledata(oopPowderNoLw, 'maxabs'), 'o', 'DisplayName', '0')
+hold on
+imap = 0;
+for ii = 101:110
+    imap = imap + 1;
+    if mod(ii, 2)
+        plot(xx*180/pi, rescaledata(oopPowderNoLwa{ii}, 'maxabs'), ...
+            'DisplayName', string(ii), 'Color', cmappa(imap, :))
+    else
+        plot(xx*180/pi, rescaledata(oopPowderNoLwa{ii}, 'maxabs'), '--', ...
+            'DisplayName', string(ii), 'Color', cmappa(imap, :))
+    end
+end
+legend()
+
+%%
+
+% clf
+% tiledlayout('flow', 'TileSpacing', 'compact', 'Padding', 'compact')
+% nexttile
+% imagesc(abs(xiNoLwPlot))
+% colorbar
+% colormap(viridis())
+% nexttile
+% imagesc(abs(xiNoLwPlot2))
+% colorbar
+% colormap(viridis())
+
+% g inh broadening
+Sys.nNuc = 0;
+Sys.lw1 = 0.35;  % mT
+Sys.lw2 = 0.35;  % mT
+Sys.nSamplegInh1 = 10;
+Sys.nSamplegInh2 = 10;
+
+clf
+plot(x*180/pi, rescaledata(y, 'maxabs'), 'o-')
+hold on
+plot(xx*180/pi, rescaledata(yy, 'maxabs'))
+plot(xx*180/pi, initFit)
+plot(xx*180/pi, initFit2)
+plot(xx*180/pi, expectFit)
+plot(xx*180/pi, rescaledata(oopPowderNoLw, 'maxabs'), 'o')
+plot(xx*180/pi, rescaledata(oopPowderNoLw1, 'maxabs'), 'x')
+plot(xx*180/pi, rescaledata(oopPowderNoLw2, 'maxabs'), 'Marker', '+', 'LineStyle', 'none')
+plot(xx*180/pi, rescaledata(oopPowderNoLw3, 'maxabs'), 'Marker','square', 'LineStyle', 'none')
+
+%%
+
+xplot = nNucs(20:548);
+yplot = xiMeanNoLwa(20:548);
+model = @(p, x) p(1)*exp(-(x/p(2)).^p(3)) + p(4);
+model2 = @(p, x) p(1)*(1./x).^p(2) + p(3);
+p0 = [0.1, 20, 0.5, 0.02];
+p02 = [0.1, 0.95, 0.02];
+
+pfit = nlinfit(xplot, yplot, model, p0);
+pfit2 = nlinfit(xplot, yplot, model2, p02);
+clf
+plot(xplot, yplot)
+hold on
+plot(xplot, model(pfit, xplot))
+yyaxis right
+plot(xplot, yplot - model(pfit, xplot))
+yline(0)
+
+%%
+
+Sys.nTheta = 2;
+Sys.nPhi = 1;
+Sys.nSamplegInh1 = 100;
+Sys.nSamplegInh2 = 100;
+Sys.nNuc = 0;
+[g1, y1, g2, y2, gmi, savexi, gfac, xiMultiplicity] = oopEseemVsBeta(Sys, 1);
+
+figure(1)
+clf
+tiledlayout('flow', 'TileSpacing', 'compact', 'Padding', 'compact')
+nexttile
+plot(g1, y1, 'o', g2, y2, 'o')
+nexttile
+imagesc(y1'*y2/sum(y1'*y2, 'all'))
+colorbar
+colormap(gca, viridis())
+nexttile
+imagesc(gmi)
+colorbar
+colormap(gca, crameri('vik', 'pivot', 0))
+nexttile
+xiplot = reshape(savexi, [1 + 2*Sys.nSamplegInh1, 1 + 2*Sys.nSamplegInh2]);
+imagesc(xiplot)
+colorbar
+colormap(gca, crameri('vik', 'pivot', 0))
+
+sum(abs(savexi.*gfac), 'all')
+
+[g1, y1, g2, y2, gmi, savexi, gfac, xiMultiplicity] = oopEseemVsBeta(Sys, 2);
+
+figure(2)
+clf
+tiledlayout('flow', 'TileSpacing', 'compact', 'Padding', 'compact')
+nexttile
+plot(g1, y1, 'o', g2, y2, 'o')
+nexttile
+imagesc(y1'*y2/sum(y1'*y2, 'all'))
+colorbar
+colormap(gca, viridis())
+nexttile
+plot(gmi)
+nexttile
+plot(gmi, savexi, 'o')
+
+sum(abs(savexi.*xiMultiplicity))
+
+%%
+% function [gax1, gInh1, gax2, gInh2, gMinusAx, savexi, gaussianFactor, xiMultiplicity] = oopEseemVsBeta(Sys, isInhBroadening)
+function [signal, xi] = oopEseemVsBeta(Sys, isInhBroadening)
+    arguments
+        Sys
+        isInhBroadening = 0
+    end
+
+    fieldAxis = Sys.x;
+    Bmean = mean(fieldAxis);
+    turningAngleAxis = Sys.turningAngleAxis;
+    dip = Sys.dip;
+    JJ = Sys.J;
+    mwFreq = Sys.mwFreq;
+    nTheta = Sys.nTheta;
+    nPhi = Sys.nPhi;
+    if isfield(Sys, 'nNuc')
+        nNuc = Sys.nNuc;
+    else
+        nNuc = 0;
+    end
+    nHfiLine = nNuc + 1;
+    
+    % Parameters for g broadening
+    lw1 = mt2mhz(Sys.lw1);
+    lw2 = mt2mhz(Sys.lw2);
+    % The g-factor linewidth
+    glw1 = freq2gvalue(Bmean, lw1);
+    glw2 = freq2gvalue(Bmean, lw2);
+    % Spacing between g-values
+    dgax1 = glw1 / Sys.nSamplegInh1;
+    dgax2 = glw2 / Sys.nSamplegInh2;
+    % resLw = min(lw1, lw2)*Sys.coeffResLw*1e-3;  % GHz
+    
+    % Grid
+    [thetas, phis] = createthetaphigrid(nTheta, nPhi);
+    nSolidAngle = nTheta*nPhi;
+
+    % Direction of B0
+    nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
+    % Effective g-values
+    g1Tensor = rotatematrixeuangles(diag(Sys.g(1, :)), Sys.gFrame(1, :));
+    g1 = sqrt( sum( (g1Tensor*nVers).^2, 1));
+    g2Tensor = rotatematrixeuangles(diag(Sys.g(2, :)), Sys.gFrame(2, :));    
+    g2 = sqrt( sum( (g2Tensor*nVers).^2, 1));
+    % Dipolar interaction
+    zD = erot(Sys.eeFrame)*[0, 0, 1]';
+    dd = dipinteraction(dip, nVers, zD);
+    
+    if nNuc > 0
+        [APlus, AMinus] = calculateaplusaminusnohfi(...
+            Sys.A, Sys.AFrame, nVers);
+    else
+        APlus = zeros(nSolidAngle, 1);
+        AMinus = zeros(nSolidAngle, 1);
+    end
+    
+    signal = zeros(numel(turningAngleAxis), nSolidAngle);
+    xi = zeros(1, nSolidAngle);
+
+    if ~isInhBroadening
+        for ii = 1:nSolidAngle
+            gPlus = 1/2*(g1(ii) + g2(ii));
+            gMinus = 1/2*(g1(ii) - g2(ii));
+    
+            w0_ = gvalue2freq(Bmean, gPlus);
+            deltaw_ = gvalue2freq(Bmean, gMinus);
+    
+            quantNumNuc = -nNuc/2:1:nNuc/2;
+            if nNuc > 0
+                pascalMatrix = pascal(nHfiLine);
+                % Antidiag
+                pascalFactor = pascalMatrix(nHfiLine:nHfiLine - 1:end - 1);
+                pascalFactor = pascalFactor'/sum(pascalFactor);
+            else
+                pascalFactor = 1;
+            end
+    
+            signal__ = zeros(numel(turningAngleAxis), nHfiLine);
+            xi__ = zeros(1, nHfiLine);
+            for ihfi = 1:nHfiLine
+                    % w0__ = w0_ + quantNumNuc(ihfi)*APlus(ii);
+                    deltaw__ = deltaw_ + quantNumNuc(ihfi)*AMinus(ii);
+                    % savedeltaw(ii, ihfi) = deltaw__;
+    
+                    xi__(ihfi) = mixinganglexi(deltaw__, JJ, dd(ii));
+                    % savexi(ii, ihfi) = xi__(ihfi);
+                    signal__(:, ihfi) = ...
+                        crystalEseem(xi__(ihfi), turningAngleAxis);
+            end
+            
+            % Average over hfi probability
+            xi(ii) = xi__*pascalFactor;
+            signal(:, ii) = signal__*pascalFactor;
+        end
+    elseif isInhBroadening == 1
+        parfor ii = 1:nSolidAngle
+            nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
+            
+            [gax1, gInh1] = creategaxisinhbroadening(g1(ii), glw1, dgax1);
+            [gax2, gInh2] = creategaxisinhbroadening(g2(ii), glw2, dgax2);
+            ngax1 = numel(gax1);
+            ngax2 = numel(gax2);
+            
+            gaussianFactor = gInh1'*gInh2;
+            gaussianFactor = gaussianFactor/sum(gaussianFactor, 'all');
+            gaussianFactor = gaussianFactor(:)';
+
+            gPlus =  ...
+                1/2*(repmat(gax1', [1, ngax2]) + repmat(gax2, [ngax1, 1]));
+            gPlus = gPlus(:)';
+            gMinus = ...
+                1/2*(repmat(gax1', [1, ngax2]) - repmat(gax2, [ngax1, 1]));
+            gMinusAx = gMinus;
+            gMinus = gMinus(:)';
+            %}
+            
+            w0_ = gvalue2freq(Bmean, gPlus);
+            deltaw_ = gvalue2freq(Bmean, gMinus);
+            % sintheta_ = sqrt( nVers(1, ii)^2 + nVers(2, ii)^2 );
+    
+            quantNumNuc = -nNuc/2:1:nNuc/2;
+            if nNuc > 0
+                pascalMatrix = pascal(nHfiLine);
+                % Antidiag
+                pascalFactor = pascalMatrix(nHfiLine:nHfiLine - 1:end - 1);
+            else
+                pascalFactor = 1;
+            end
+            
+            signal__ = zeros(numel(turningAngleAxis), nHfiLine, numel(gaussianFactor));
+            xi__ = zeros(1, nHfiLine, numel(gaussianFactor));
+            for ihfi = 1:nHfiLine
+                % w0__ = w0_ + quantNumNuc(ihfi)*APlus(ii);
+                deltaw__ = deltaw_ + quantNumNuc(ihfi)*AMinus(ii);
+
+                xi__(1, ihfi, :) = mixinganglexi(deltaw__, JJ, dd(ii));
+                savexi = xi__(ihfi, :);
+                signal__(:, ihfi, :) = ...
+                    crystalEseem(xi__(1, ihfi, :), turningAngleAxis);
+            end
+            xi(ii) = squeeze(sum(...
+                xi__.*reshape(gaussianFactor, [1, size(gaussianFactor)]), ...
+                3 ...
+                ))*pascalFactor;
+            signal(:, ii) = squeeze(sum(...
+                signal__.*reshape(gaussianFactor, [1, size(gaussianFactor)]), ...
+                3 ...
+                ))*pascalFactor;
+        end
+    elseif isInhBroadening == 2
+        parfor ii = 1:nSolidAngle
+            nVers = ang2vec(ones(nTheta, 1)*phis, thetas*ones(1, nPhi));
+            
+            [gax1, gInh1] = creategaxisinhbroadening(g1(ii), glw1, dgax1);
+            [gax2, gInh2] = creategaxisinhbroadening(g2(ii), glw2, dgax2);
+            ngax1 = numel(gax1);
+            ngax2 = numel(gax2);
+            
+            % It is not necessary to calculate every possible combination
+            % but 
+            gMinusAx = [flip((gax1 - gax2(1))/2), ...
+                (gax1(1) - gax2(2:end))/2];
+            ngMinusAx = ngax1 + ngax2 - 1;
+            
+%             w0_ = gvalue2freq(Bmean, gPlus);
+            deltaw_ = gvalue2freq(Bmean, gMinusAx);
+            % sintheta_ = sqrt( nVers(1, ii)^2 + nVers(2, ii)^2 );
+    
+            gaussianFactor = gInh1'*gInh2;
+            gaussianFactor = gaussianFactor/sum(gaussianFactor, 'all');
+            diagsToExtract = -(ngax1 - 1):(ngax2 - 1);  % All the diagonals
+            xiMultiplicity = sum(spdiags(...
+                gaussianFactor, diagsToExtract), 1);
+        
+            quantNumNuc = -nNuc/2:1:nNuc/2;
+            if nNuc > 0
+                pascalMatrix = pascal(nHfiLine);
+                % Antidiag
+                pascalFactor = pascalMatrix(nHfiLine:nHfiLine - 1:end - 1);
+            else
+                pascalFactor = 1;
+            end
+            
+            signal__ = zeros(numel(turningAngleAxis), nHfiLine, ngMinusAx);
+            xi__ = zeros(1, nHfiLine, ngMinusAx);
+            for ihfi = 1:nHfiLine
+                % w0__ = w0_ + quantNumNuc(ihfi)*APlus(ii);
+                deltaw__ = deltaw_ + quantNumNuc(ihfi)*AMinus(ii);
+
+                xi__(1, ihfi, :) = mixinganglexi(deltaw__, JJ, dd(ii));
+%                 savexi = xi__(ihfi, :);
+                signal__(:, ihfi, :) = ...
+                    crystalEseem(xi__(1, ihfi, :), turningAngleAxis);
+            end
+            xi(ii) = squeeze(sum(...
+                xi__.*reshape(xiMultiplicity, [1, 1, ngMinusAx]), ...
+                3 ...
+                ))*pascalFactor;
+            signal(:, ii) = squeeze(sum(...
+                signal__.*reshape(xiMultiplicity, [1, 1, ngMinusAx]), ...
+                3 ...
+                ))*pascalFactor;
+        end
+    end
+end
+
+
+function signal = crystalEseem(p, beta)
+% p = xi = 2alpha
+% beta = xx is the turning angle axis
+signal = - (1/2 * sin(2*beta) .* cos(p).^4 + ...
+            1/4 * sin(beta) .* sin(2*p).^2);
+end
+%{
+
 % Temporal prefactor sin(2*(dd - JJ)*tau)
 if tau ~= 0
     timePrefac = sin(2*(dd - JJ)*tau);
@@ -1113,7 +1492,7 @@ end
 
 
 
-
+%}