core_shell_microgelscostrafo411magnetic_modelrelease_v0.94release_v0.95ticket-1257-vesicle-productticket_1156ticket_1265_superballticket_822_more_unit_tests
Last change
on this file since 58c3367 was
2c74c11,
checked in by Paul Kienzle <pkienzle@…>, 8 years ago
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implicit Iqxy; fix divide by 0 for q=0
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-
Property mode set to
100644
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File size:
1.2 KB
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1 | double form_volume(double radius); |
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2 | |
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3 | double Iq(double q, |
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4 | double mass_dim, |
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5 | double surface_dim, |
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6 | double cluster_rg, |
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7 | double primary_rg); |
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8 | |
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9 | static double _mass_surface_fractal_kernel(double q, |
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10 | double mass_dim, |
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11 | double surface_dim, |
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12 | double cluster_rg, |
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13 | double primary_rg) |
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14 | { |
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15 | //computation |
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16 | double tot_dim = 6.0 - surface_dim - mass_dim; |
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17 | mass_dim /= 2.0; |
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18 | tot_dim /= 2.0; |
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19 | |
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20 | double rc_norm = cluster_rg * cluster_rg / (3.0 * mass_dim); |
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21 | double rp_norm = primary_rg * primary_rg / (3.0 * tot_dim); |
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22 | |
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23 | //x for P |
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24 | double x_val1 = 1.0 + q * q * rc_norm; |
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25 | double x_val2 = 1.0 + q * q * rp_norm; |
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26 | |
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27 | double inv_form = pow(x_val1, mass_dim) * pow(x_val2, tot_dim); |
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28 | |
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29 | //another singular |
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30 | if (inv_form == 0.0) return 0.0; |
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31 | |
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32 | double form_factor = 1.0; |
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33 | form_factor /= inv_form; |
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34 | |
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35 | return (form_factor); |
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36 | } |
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37 | double form_volume(double radius){ |
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38 | |
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39 | return 1.333333333333333*M_PI*radius*radius*radius; |
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40 | } |
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41 | |
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42 | double Iq(double q, |
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43 | double mass_dim, |
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44 | double surface_dim, |
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45 | double cluster_rg, |
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46 | double primary_rg) |
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47 | { |
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48 | return _mass_surface_fractal_kernel(q, |
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49 | mass_dim, |
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50 | surface_dim, |
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51 | cluster_rg, |
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52 | primary_rg); |
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53 | } |
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