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Commit fff04e14 authored by Matheus Müller's avatar Matheus Müller
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Calculo por metodo de camadas operacional

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numerical.py
View file @ fff04e14
......@@ -7,6 +7,7 @@ from pylab import *
from numpy import nan_to_num, zeros
from scipy.special import i1
from Ewindow import Edict
from layers import Ldict
PI=math.pi
......@@ -172,4 +173,100 @@ def spectro(p, modelo, ion, OFlabentries, LScontrol, CGausscontrol):
####################################################################################################################################################
def spectrolayer(p, modelo, ion, OFlabentries, LScontrol, CGausscontrol):
return 0
EPasso = float(OFlabentries[16].get())
passox = float(OFlabentries[17].get())
e = arange(float(OFlabentries[14].get()), float(OFlabentries[15].get()), EPasso)
resol = float(OFlabentries[13].get())
X = e*0.
dose = 12e34
gshift=0.
antizerodiv=0.
Theta_s = PI - (p['Theta_in'] + p['Theta_out'])*PI/180
mi = ion['mass']
for camada in Ldict:
## Calcula o espectro de cada elemento da amostra
for componente in range(len(camada.Elements)):
mt = camada.Elements[componente]['mass']
c = float(camada.Spinboxes[componente].get())
alpha_lineshape = camada.Elements[componente]['LineShape']
dedx = float(camada.LandE[4].get())
dW2dx = float(camada.LandE[5].get())
k = ((sqrt (mt**2+mi**2*(sin(Theta_s)**2)) + mi*cos(Theta_s) ) / (mi+mt) )**2
dedxef=dedx*(k/cos(p['Theta_in']*PI/180.) + 1/cos(p['Theta_out']*PI/180.))
dw2dxef=dW2dx*(k**2./cos(p['Theta_in']*PI/180.)+1./cos(p['Theta_out']*PI/180.))
sinalbessel = e*0
sinalgaussiana = e*0
xinit = float(camada.LandE[6].get())
xfinal = float(camada.LandE[7].get())
if xinit == 0:
antizerodiv = passox
else:
antizerodiv = 0
# Calcula a contribuição de cada camada
for x in arange(xinit+antizerodiv, xfinal, passox):
# Seção de choque - CSRf(Z1, Z2, Ein, M1, M2, Theta):
CS = c*k*CSRf(ion['Z'], camada.Elements[componente]['Z'], k*p['E0']-dedxef*x, mi, mt, Theta_s)*passox
# É multiplicada pelo passo para manter a escala do gráfico independente do mesmo.
# Bessel:
# Ainda falta incluir a delta de Dirac na origem
# Existe um valor máximo em energia no qual a função de Bessel pode ser computada em função
# da precisão numérica. Uma possível solução pode ser trabalhar em outras unidades que não
# resultem em argumentos tão grandes para a função exponencial.
# Também temos um problema com a primeira camada, que tem profundidade zero.
# Perceba que os cálculos de Bessel correspondentes às camadas mais fundas estão truncados
# para uma perda de energia maior que 25 keV. (Observado com Theta_in=70, para x > 30)
if modelo == 'bessel':
alpha=dedxef*(2./dw2dxef)
m=alpha*dedxef
lbd=m*x*alpha
besselcamada = lbd*exp(-m*x-alpha*(k*p['E0']-e))*i1(2.*sqrt(lbd*(k*p['E0']-e)))/(sqrt(lbd*(k*p['E0']-e)))
sinalbessel = besselcamada*CS+sinalbessel
# Gaussiana:
elif modelo == 'gaussiana':
Em=k*p['E0']-x*dedxef
sigma=x*dw2dxef
gaussianacamada = exp((-(e-Em)**2)/(2.*sigma))/sqrt(2.*PI*sigma)
sinalgaussiana = gaussianacamada*CS+sinalgaussiana
if modelo == 'bessel':
besself = nan_to_num(sinalbessel)
if LScontrol == 1:
besself = convoluiF0(besself, alpha_lineshape, EPasso)
X = besself + X
linecolor='r'
elif modelo == 'gaussiana':
if LScontrol == 1:
sinalgaussiana = convoluiF0(sinalgaussiana, alpha_lineshape, EPasso)
X = sinalgaussiana + X
linecolor='b'
if CGausscontrol == 1:
X, gshift = convoluiGauss(X,resol/2.35482,EPasso)
plt.plot(e-gshift,X*dose, linecolor)
ylim([0,max(X*dose)*1.1])
suptitle('Signal received', fontsize=12)
xlabel("Enegy (eV)")
ylabel("Yield")
data2 = open('temp.sim', 'w')
for i in range(len(X)):
print>>data2, e[i]-gshift,X[i]*dose
data2.close()
show()
####################################################################################################################################################
####################################################################################################################################################
numerical.pyc
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temp.sim
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