Changeset 65fbf7c in sasmodels
 Timestamp:
 May 21, 2018 5:33:49 PM (13 months ago)
 Branches:
 master, core_shell_microgels, magnetic_model, ticket1257vesicleproduct, ticket_1156, ticket_1265_superball, ticket_822_more_unit_tests
 Children:
 2b2d431
 Parents:
 87964ac
 Location:
 sasmodels
 Files:

 2 edited
Legend:
 Unmodified
 Added
 Removed

sasmodels/compare.py
r1198f90 r65fbf7c 667 667 if opts['zero']: 668 668 q = np.hstack((0, q)) 669 data = empty_data1D(q, resolution=res) 669 # TODO: provide command line control of lambda and Delta lambda/lambda 670 #L, dLoL = 5, 0.14/np.sqrt(6) # wavelength and 14% triangular FWHM 671 L, dLoL = 0, 0 672 data = empty_data1D(q, resolution=res, L=L, dL=L*dLoL) 670 673 index = slice(None, None) 671 674 return data, index … … 871 874 # Plot if requested 872 875 view = opts['view'] 876 #view = 'log' 873 877 if limits is None: 874 878 vmin, vmax = np.inf, np.inf 
sasmodels/data.py
rd86f0fc r65fbf7c 36 36 37 37 import numpy as np # type: ignore 38 from numpy import sqrt, sin, cos, pi 38 39 39 40 # pylint: disable=unusedimport … … 301 302 302 303 303 def empty_data1D(q, resolution=0.0 ):304 def empty_data1D(q, resolution=0.0, L=0., dL=0.): 304 305 # type: (np.ndarray, float) > Data1D 305 """306 r""" 306 307 Create empty 1D data using the given *q* as the x value. 307 308 308 *resolution* dq/q defaults to 5%. 309 rms *resolution* $\Delta q/q$ defaults to 0%. If wavelength *L* and rms 310 wavelength divergence *dL* are defined, then *resolution* defines 311 rms $\Delta \theta/\theta$ for the lowest *q*, with $\theta$ derived from 312 $q = 4\pi/\lambda \sin(\theta)$. 309 313 """ 310 314 … … 313 317 Iq, dIq = None, None 314 318 q = np.asarray(q) 315 data = Data1D(q, Iq, dx=resolution * q, dy=dIq) 319 if L != 0 and resolution != 0: 320 theta = np.arcsin(q*L/(4*pi)) 321 dtheta = theta[0]*resolution 322 ## Solving Gaussian error propagation from 323 ## Dq^2 = (dq/dL)^2 DL^2 + (dq/dtheta)^2 Dtheta^2 324 ## gives 325 ## (Dq/q)^2 = (DL/L)**2 + (Dtheta/tan(theta))**2 326 ## Take the square root and multiply by q, giving 327 ## Dq = (4*pi/L) * sqrt((sin(theta)*dL/L)**2 + (cos(theta)*dtheta)**2) 328 dq = (4*pi/L) * sqrt((sin(theta)*dL/L)**2 + (cos(theta)*dtheta)**2) 329 else: 330 dq = resolution * q 331 332 data = Data1D(q, Iq, dx=dq, dy=dIq) 316 333 data.filename = "fake data" 317 334 return data
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