Changeset 475ff58 in sasmodels
- Timestamp:
- Sep 7, 2018 11:49:04 AM (6 years ago)
- Branches:
- master, core_shell_microgels, magnetic_model, ticket-1257-vesicle-product, ticket_1156, ticket_1265_superball, ticket_822_more_unit_tests
- Children:
- c11d09f, 1a3c0c6
- Parents:
- 992299c
- File:
-
- 1 edited
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sasmodels/models/spinodal.py
ref07e95 r475ff58 3 3 ---------- 4 4 5 This model calculates the SAS signal of a phase separating solution 6 under spinodal decomposition. The scattering intensity $I(q)$ is calculated as 5 This model calculates the SAS signal of a phase separating system 6 undergoing spinodal decomposition. The scattering intensity $I(q)$ is calculated 7 as 7 8 8 9 .. math:: 9 10 I(q) = I_{max}\frac{(1+\gamma/2)x^2}{\gamma/2+x^{2+\gamma}}+B 10 11 11 where $x=q/q_0$ and $B$ is a flat background. The characteristic structure 12 length scales with the correlation peak at $q_0$. The exponent $\gamma$ is 13 equal to $d+1$ with d the dimensionality of the off-critical concentration 14 mixtures. A transition to $\gamma=2d$ is seen near the percolation threshold 15 into the critical concentration regime. 12 where $x=q/q_0$, $q_0$ is the peak position, $I_{max}$ is the intensity 13 at $q_0$ (parameterised as the $scale$ parameter), and $B$ is a flat 14 background. The spinodal wavelength is given by $2\pi/q_0$. 15 16 The exponent $\gamma$ is equal to $d+1$ for off-critical concentration 17 mixtures (smooth interfaces) and $2d$ for critical concentration mixtures 18 (entangled interfaces), where $d$ is the dimensionality (ie, 1, 2, 3) of the 19 system. Thus 2 <= $\gamma$ <= 6. A transition from $\gamma=d+1$ to $\gamma=2d$ 20 is expected near the percolation threshold. 21 22 As this function tends to zero as $q$ tends to zero, in practice it may be 23 necessary to combine it with another function describing the low-angle 24 scattering, or to simply omit the low-angle scattering from the fit. 16 25 17 26 References … … 22 31 Physica A 123,497 (1984). 23 32 24 Authorship and Verification 25 ---------------- ------------33 Revision History 34 ---------------- 26 35 27 * **Author:** Dirk Honecker **Date:** Oct 7, 2016 36 * **Author:** Dirk Honecker **Date:** Oct 7, 2016 37 * **Revised:** Steve King **Date:** Sep 7, 2018 28 38 """ 29 39 … … 34 44 title = "Spinodal decomposition model" 35 45 description = """\ 36 I(q) = scale ((1+gamma/2)x^2)/(gamma/2+x^(2+gamma))+background46 I(q) = Imax ((1+gamma/2)x^2)/(gamma/2+x^(2+gamma)) + background 37 47 38 48 List of default parameters: 39 scale = scaling 40 gamma = exponent 41 x = q/q_0 49 50 Imax = correlation peak intensity at q_0 51 background = incoherent background 52 gamma = exponent (see model documentation) 42 53 q_0 = correlation peak position [1/A] 43 background = Incoherent background""" 54 x = q/q_0""" 55 44 56 category = "shape-independent" 45 57
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