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more stopping power coefficient options

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This patch modularizes the code responsible for selecting the stopping power coefficients. Specifically, it:

- moves the data in `elemPars` to seperate JSON files in the `data/` directory. This makes it easier to modify the existing data or add new data sources. Note that this refactoring does not alter the previous functionality - the contents of each file are simply read and deep-merged into an initially empty `elemPars` object.
- adds the original Varelas-Biersack parameters from Anderson & Ziegler (1977).
- updates the "Other Parameters" tab in the GUI for easy toggling between the different stopping power coefficient data sources.
This commit is contained in:
ext-mcfadd_r
2024-08-12 16:24:42 -07:00
parent 8222bab5ea
commit 391c25ef93
8 changed files with 3005 additions and 837 deletions
Download Patch File Download Diff File Expand all files Collapse all files
TrimSP.html
+11 -5
View File
@@ -310,14 +310,20 @@
</tr>
<tr>
<td class="tooltip">
<input type="checkbox" id="flagICRU" checked>
Stopping Power<br>Coefficients
<span class="tooltiptext">
Force the TRIM.SP code to use stopping power
parameters from the old ICRU tables.
</span>
Data source for the Varelas-Biersack parameterization of electronic
stopping cross-sections for proton-like projectiles implanted in
elemental targets:
<ol>
<li value="1">Table 1 in Anderson & Ziegler (1977).</li>
<li value="2">Table 3.1 in ICRU Report 49 (1993).</li>
<li value="3">Table II in McFadden et al. (2023) and McFadden et al. (unpublished).</li>
</ol>
</span>
</td>
<td>
Use ICRU parameters
<input name="flagSPC" id="flagSPC" type="number" step="1" min="1" max="3" value="2">
</td>
<td class="tooltip">
IRL
TrimSPlib.js
+84 -832
View File
@@ -1,823 +1,64 @@
// This file contains function that are generic Javascript for TrimSP
// This is an object that contains all GUI ids and values
var All = new Object();
// This is an object that contains all elements and their parameters
// To replace all other functions
const elemPars = {
muon : {
Z : 1 ,
A : 0.1134289259 ,
rho : 0 ,
Elast : 0 ,
ICRU : [] ,
IAEA : []
},
"Li-8" : {
Z : 3 ,
A : 8.02248624 ,
rho : 0 ,
Elast : 0 ,
ICRU : [] ,
IAEA : []
},
"B-12" : {
Z : 5 ,
A : 12.0143526 ,
rho : 0 ,
Elast : 0 ,
ICRU : [] ,
IAEA : []
},
"Mg-31" : {
Z : 12 ,
A : 30.996648 ,
rho : 0 ,
Elast : 0 ,
ICRU : [] ,
IAEA : []
},
H : {
Z : 1 ,
A : 1.008 ,
rho : 0.08 ,
Elast : 0.1 ,
ICRU : [1.25400,1.44000,242.60001,12000.00000,0.11590],
IAEA : [1.21941306,1.39705253,316.72610292,3622.08960714,0.03609996]
},
He : {
Z : 2 ,
A : 4.003 ,
rho : 0.12 ,
Elast : 0.1 ,
ICRU : [1.22900,1.39700,484.50000,5873.00000,0.05225] ,
IAEA : []
},
Li : {
Z : 3 ,
A : 6.939 ,
rho : 0.53 ,
Elast : 1.63 ,
ICRU : [1.41100,1.60000,725.59998,3013.00000,0.04578] ,
IAEA : [2.55867734,2.98398784,672.22623329,223.63937274,0.05756479]
},
Be : {
Z : 4 ,
A : 9.012 ,
rho : 1.85 ,
Elast : 3.32 ,
ICRU : [2.24800,2.59000,966.00000,153.80000,0.03475] ,
IAEA : [2.13846776,2.43024550,1353.80005691,500.78353377,0.01143076]
},
B : {
Z : 5 ,
A : 10.811 ,
rho : 2.34 ,
Elast : 5.77 ,
ICRU : [2.47400,2.81500,1206.00000,1060.00000,0.02855] ,
IAEA : [2.92598306,3.33271910,1523.83401267,574.31712932,0.01671298]
},
C : {
Z : 6 ,
A : 12.011 ,
rho : 2.26 ,
Elast : 7.37 ,
ICRU : [2.60100,2.60100,1701.00000,1279.00000,0.01638] ,
IAEA : [2.51057212,2.84874359,1325.63086028,2111.57332043,0.03815981]
},
N : {
Z : 7 ,
A : 14.007 ,
rho : 1.03 ,
Elast : 4.92 ,
ICRU : [2.95400,3.35000,1683.00000,1900.00000,0.02513] ,
IAEA : [3.03231463,3.44621744,1287.27189959,3445.25706665,0.06909550]
},
O : {
Z : 8 ,
A : 15.999 ,
rho : 2 ,
Elast : 2.6 ,
ICRU : [2.65200,3.00000,1920.00000,2000.00000,0.02230] ,
IAEA : [2.58218404,2.91913321,2066.69556610,1937.28839450,0.01708201]
},
F : {
Z : 9 ,
A : 18.998 ,
rho : 1.11 ,
Elast : 0.84 ,
ICRU : [2.08500,2.35200,2157.00000,2634.00000,0.01816] ,
IAEA : []
},
Ne : {
Z : 10 ,
A : 20.183 ,
rho : 1.5 ,
Elast : 0.02 ,
ICRU : [1.95100,2.19900,2393.00000,2699.00000,0.01568] ,
IAEA : []
},
Na : {
Z : 11 ,
A : 22.99 ,
rho : 0.97 ,
Elast : 1.11 ,
ICRU : [2.54200,2.86900,2628.00000,1854.00000,0.01472] ,
IAEA : []
},
Mg : {
Z : 12 ,
A : 24.312 ,
rho : 1.74 ,
Elast : 1.51 ,
ICRU : [3.79100,4.29300,2862.00000,1009.00000,0.01397] ,
IAEA : [4.32219620,4.95332934,2711.05757349,99.32422512,0.01692829]
},
Al : {
Z : 13 ,
A : 26.982 ,
rho : 2.7 ,
Elast : 3.39 ,
ICRU : [4.15400,4.73900,2766.00000,164.50000,0.02023] ,
IAEA : [4.16266645,4.73942640,3007.21967155,192.15430476,0.01478852]
},
Si : {
Z : 14 ,
A : 28.086 ,
rho : 2.33 ,
Elast : 4.63 ,
ICRU : [4.91400,5.59800,3193.00000,232.70000,0.01419] ,
IAEA : [4.56277193,5.17964542,3812.93366288,249.45105835,0.00951865]
},
P : {
Z : 15 ,
A : 30.974 ,
rho : 1 ,
Elast : 3.43 ,
ICRU : [3.23200,3.64700,3561.00000,1560.00000,0.01267] ,
IAEA : []
},
S : {
Z : 16 ,
A : 32.064 ,
rho : 2.07 ,
Elast : 2.85 ,
ICRU : [3.44700,3.89100,3792.00000,1219.00000,0.01211] ,
IAEA : []
},
Cl : {
Z : 17 ,
A : 35.453 ,
rho : 2.03 ,
Elast : 1.4 ,
ICRU : [5.30100,6.00800,3969.00000,645.09998,0.01183] ,
IAEA : [5.18954121,5.87010049,5726.20198003,338.90592713,0.00527894]
},
Ar : {
Z : 18 ,
A : 39.948 ,
rho : 1.77 ,
Elast : 0.08 ,
ICRU : [5.73100,6.50000,4253.00000,530.00000,0.01123] ,
IAEA : []
},
K : {
Z : 19 ,
A : 39.102 ,
rho : 0.86 ,
Elast : 0.93 ,
ICRU : [5.15200,5.83300,4482.00000,545.70001,0.01129] ,
IAEA : []
},
Ca : {
Z : 20 ,
A : 40.08 ,
rho : 1.55 ,
Elast : 1.84 ,
ICRU : [5.52100,6.25200,4710.00000,553.29999,0.01120] ,
IAEA : [7.38419020,8.41800474,4257.94547049,311.84732092,0.01482602]
},
Sc : {
Z : 21 ,
A : 44.956 ,
rho : 2.99 ,
Elast : 3.9 ,
ICRU : [5.20100,5.88400,4938.00000,560.90002,0.01000] ,
IAEA : [6.27366940,7.11486087,5202.32117316,349.64931132,0.00808596]
},
Ti : {
Z : 22 ,
A : 47.9 ,
rho : 4.54 ,
Elast : 4.85 ,
ICRU : [4.85800,5.48900,5260.00000,651.09998,0.00893] ,
IAEA : [4.89215322,5.52996090,4733.05002706,821.54929980,0.01141794]
},
V : {
Z : 23 ,
A : 50.942 ,
rho : 6.11 ,
Elast : 5.31 ,
ICRU : [4.47900,5.05500,5391.00000,952.29999,0.00912] ,
IAEA : [4.39418898,4.95984106,5216.28902299,873.00768319,0.00982301]
},
Cr : {
Z : 24 ,
A : 51.996 ,
rho : 7.19 ,
Elast : 4.1 ,
ICRU : [3.98300,4.48900,5616.00000,1336.00000,0.00841] ,
IAEA : [4.22355616,4.76724205,4805.40719904,1062.25237873,0.01508696]
},
Mn : {
Z : 25 ,
A : 54.938 ,
rho : 7.43 ,
Elast : 2.92 ,
ICRU : [3.46900,3.90700,5725.00000,1461.00000,0.00883] ,
IAEA : [3.45870888,3.89580224,5452.18588822,1778.16054656,0.01057380]
},
Fe : {
Z : 26 ,
A : 55.847 ,
rho : 7.87 ,
Elast : 4.28 ,
ICRU : [3.51900,3.96300,6065.00000,1243.00000,0.00778] ,
IAEA : [3.69846643,4.16916938,5392.90710239,1040.38447053,0.01152298]
},
Co : {
Z : 27 ,
A : 58.933 ,
rho : 8.9 ,
Elast : 4.39 ,
ICRU : [3.14000,3.53500,6288.00000,1372.00000,0.00736] ,
IAEA : [3.55890909,4.00775461,6796.04145497,933.86447935,0.00558368]
},
Ni : {
Z : 28 ,
A : 58.71 ,
rho : 8.9 ,
Elast : 4.44 ,
ICRU : [3.55300,4.00400,6205.00000,555.09998,0.00876] ,
IAEA : [3.42262695,3.86234880,4759.65515188,520.18934465,0.02026669]
},
Cu : {
Z : 29 ,
A : 63.54 ,
rho : 8.96 ,
Elast : 3.49 ,
ICRU : [3.69600,4.19400,4649.00000,81.13000,0.02242] ,
IAEA : [3.54912421,4.02142201,4344.22605325,128.32905834,0.02886218]
},
Zn : {
Z : 30 ,
A : 65.37 ,
rho : 7.13 ,
Elast : 1.35 ,
ICRU : [4.21000,4.75000,6953.00000,295.20001,0.00681] ,
IAEA : [4.31895518,4.91763977,5346.03925560,46.16548699,0.01518164]
},
Ga : {
Z : 31 ,
A : 69.72 ,
rho : 5.91 ,
Elast : 2.81 ,
ICRU : [5.04100,5.69700,7137.00000,202.60001,0.00673] ,
IAEA : [4.11015447,4.63998531,7681.41419449,149.38563152,0.00628772]
},
Ge : {
Z : 32 ,
A : 72.59 ,
rho : 5.32 ,
Elast : 3.85 ,
ICRU : [5.55400,6.30000,6496.00000,110.00000,0.00969] ,
IAEA : [5.80984815,6.60667983,6039.04808738,87.19744473,0.01158192]
},
As : {
Z : 33 ,
A : 74.922 ,
rho : 5.72 ,
Elast : 2.96 ,
ICRU : [5.32300,6.01200,7611.00000,292.50000,0.00645] ,
IAEA : []
},
Se : {
Z : 34 ,
A : 78.96 ,
rho : 4.79 ,
Elast : 2.25 ,
ICRU : [5.87400,6.65600,7395.00000,117.50000,0.00768] ,
IAEA : [5.58734301,6.31119973,8423.01872583,221.61559131,0.00530434]
},
Br : {
Z : 35 ,
A : 79.909 ,
rho : 3.14 ,
Elast : 1.22 ,
ICRU : [6.65800,7.53600,7694.00000,222.30000,0.00651] ,
IAEA : [6.28480648,7.09489448,11732.76411988,150.96205589,0.00281298]
},
Kr : {
Z : 36 ,
A : 83.8 ,
rho : 3.1 ,
Elast : 0.12 ,
ICRU : [6.41300,7.24000,11850.00000,153.70000,0.00288] ,
IAEA : [6.47378266,7.31581518,9199.06183849,216.98680923,0.00437111]
},
Rb : {
Z : 37 ,
A : 85.47 ,
rho : 1.53 ,
Elast : 0.85 ,
ICRU : [5.69400,6.42900,8478.00000,292.89999,0.00609] ,
IAEA : [8.48759187,9.62951209,7271.11124671,272.67996745,0.00818815]
},
Sr : {
Z : 38 ,
A : 87.62 ,
rho : 2.54 ,
Elast : 1.72 ,
ICRU : [6.33900,7.15900,8693.00000,330.29999,0.00600] ,
IAEA : [8.66447838,9.84912713,5979.31960977,334.15705556,0.01184544]
},
Y : {
Z : 39 ,
A : 88.905 ,
rho : 4.47 ,
Elast : 4.37 ,
ICRU : [6.40700,7.23400,8907.00000,367.79999,0.00589] ,
IAEA : [7.54854264,8.54789357,6885.34110669,429.53252110,0.00930644]
},
Zr : {
Z : 40 ,
A : 91.22 ,
rho : 6.51 ,
Elast : 6.25 ,
ICRU : [6.73400,7.60300,9120.00000,405.20001,0.00576] ,
IAEA : [6.24168401,7.04236496,10674.06252597,269.66181445,0.00339805]
},
Nb : {
Z : 41 ,
A : 92.906 ,
rho : 8.57 ,
Elast : 7.57 ,
ICRU : [6.90100,7.79100,9333.00000,442.70001,0.00559] ,
IAEA : [5.96194954,6.72632300,10250.57513827,275.25886405,0.00386599]
},
Mo : {
Z : 42 ,
A : 95.94 ,
rho : 10.22 ,
Elast : 6.82 ,
ICRU : [6.42400,7.24800,9545.00000,480.20001,0.00538] ,
IAEA : [5.58867862,6.29983727,9573.16605660,523.57577519,0.00473082]
},
Tc : {
Z : 43 ,
A : 98 ,
rho : 11.5 ,
Elast : 6.85 ,
ICRU : [6.79900,7.67100,9756.00000,517.59998,0.00532] ,
IAEA : []
},
Ru : {
Z : 44 ,
A : 101.07 ,
rho : 12.37 ,
Elast : 6.74 ,
ICRU : [6.10900,6.88700,9966.00000,555.09998,0.00515] ,
IAEA : []
},
Rh : {
Z : 45 ,
A : 102.905 ,
rho : 12.41 ,
Elast : 5.75 ,
ICRU : [5.92400,6.67700,10180.00000,592.50000,0.00492] ,
IAEA : []
},
Pd : {
Z : 46 ,
A : 106.4 ,
rho : 12.02 ,
Elast : 3.89 ,
ICRU : [5.23800,5.90000,10380.00000,630.00000,0.00476] ,
IAEA : [4.74762031,5.34871025,8086.17802763,942.05721488,0.00842671]
},
Ag : {
Z : 47 ,
A : 107.87 ,
rho : 10.5 ,
Elast : 2.95 ,
ICRU : [5.34500,6.03800,6790.00000,397.79999,0.01676] ,
IAEA : [5.42052240,6.17824432,4642.18214950,90.75350922,0.06061521]
},
Cd : {
Z : 48 ,
A : 112.4 ,
rho : 8.65 ,
Elast : 1.16 ,
ICRU : [5.81400,6.55400,10800.00000,355.50000,0.00463] ,
IAEA : [4.89128643,5.50754704,11831.77188508,396.06905848,0.00412049]
},
In : {
Z : 49 ,
A : 114.82 ,
rho : 7.31 ,
Elast : 2.52 ,
ICRU : [6.22900,7.02400,11010.00000,370.89999,0.00454] ,
IAEA : [5.98978289,6.77050040,6343.54720062,564.65410792,0.02270520]
},
Sn : {
Z : 50 ,
A : 118.69 ,
rho : 7.31 ,
Elast : 3.14 ,
ICRU : [6.40900,7.22700,11210.00000,386.39999,0.00447] ,
IAEA : [6.73191335,7.61854414,6946.18830598,347.19391310,0.01677246]
},
Sb : {
Z : 51 ,
A : 121.75 ,
rho : 6.68 ,
Elast : 2.75 ,
ICRU : [7.50000,8.48000,8608.00000,348.00000,0.00907] ,
IAEA : [7.92400389,8.99628409,5736.29881090,403.11722206,0.02973016]
},
Te : {
Z : 52 ,
A : 127.6 ,
rho : 6.24 ,
Elast : 2.23 ,
ICRU : [6.97900,7.87100,11620.00000,392.39999,0.00440] ,
IAEA : []
},
I : {
Z : 53 ,
A : 126.904 ,
rho : 4.93 ,
Elast : 1.11 ,
ICRU : [7.72500,8.71600,11830.00000,394.79999,0.00438] ,
IAEA : []
},
Xe : {
Z : 54 ,
A : 131.3 ,
rho : 3.8 ,
Elast : 0.16 ,
ICRU : [8.33700,9.42500,10510.00000,269.60001,0.00621] ,
IAEA : [8.96826400,10.16224223,8543.27304860,283.90067433,0.01019984]
},
Cs : {
Z : 55 ,
A : 132.905 ,
rho : 1.9 ,
Elast : 0.8 ,
ICRU : [7.28700,8.21800,12230.00000,399.70001,0.00445] ,
IAEA : []
},
Ba : {
Z : 56 ,
A : 137.34 ,
rho : 3.59 ,
Elast : 1.9 ,
ICRU : [7.89900,8.91100,12430.00000,402.10001,0.00451] ,
IAEA : []
},
La : {
Z : 57 ,
A : 138.91 ,
rho : 6.15 ,
Elast : 4.47 ,
ICRU : [8.04100,9.07100,12630.00000,404.50000,0.00454] ,
IAEA : [8.16949326,9.21144395,13933.96869212,429.99442382,0.00347440]
},
Ce : {
Z : 58 ,
A : 140.12 ,
rho : 6.77 ,
Elast : 4.32 ,
ICRU : [7.48800,8.44400,12830.00000,406.89999,0.00442] ,
IAEA : []
},
Pr : {
Z : 59 ,
A : 140.907 ,
rho : 6.77 ,
Elast : 3.7 ,
ICRU : [7.29100,8.21900,13030.00000,409.29999,0.00430] ,
IAEA : []
},
Nd : {
Z : 60 ,
A : 144.24001 ,
rho : 7.01 ,
Elast : 3.4 ,
ICRU : [7.09800,8.00000,13230.00000,411.79999,0.00418] ,
IAEA : [8.60801371,10.26060598,6798.65217629,7.06731816,0.02713704]
},
Pm : {
Z : 61 ,
A : 147 ,
rho : 7.22 ,
Elast : 0.1 ,
ICRU : [6.90900,7.78600,13430.00000,414.20001,0.00406] ,
IAEA : []
},
Sm : {
Z : 62 ,
A : 150.35001 ,
rho : 7.52 ,
Elast : 2.14 ,
ICRU : [6.72800,7.58000,13620.00000,416.60001,0.00398] ,
IAEA : []
},
Eu : {
Z : 63 ,
A : 151.96001 ,
rho : 5.24 ,
Elast : 1.86 ,
ICRU : [6.55100,7.38000,13820.00000,419.00000,0.00388] ,
IAEA : []
},
Gd : {
Z : 64 ,
A : 157.25 ,
rho : 7.9 ,
Elast : 4.14 ,
ICRU : [6.73900,7.59200,14020.00000,421.39999,0.00386] ,
IAEA : [8.38379061,9.50012183,10804.38767518,110.71066098,0.00761735]
},
Tb : {
Z : 65 ,
A : 158.924 ,
rho : 8.23 ,
Elast : 4.05 ,
ICRU : [6.21200,6.99600,14210.00000,423.89999,0.00372] ,
IAEA : [8.69907359,10.36476708,5985.09307671,7.76175759,0.04237031]
},
Dy : {
Z : 66 ,
A : 162.5 ,
rho : 8.55 ,
Elast : 3.04 ,
ICRU : [5.51700,6.21000,14400.00000,426.29999,0.00363] ,
IAEA : [6.69350026,7.81543484,5289.65107666,12.11560717,0.05746489]
},
Ho : {
Z : 67 ,
A : 164.92999 ,
rho : 8.8 ,
Elast : 3.14 ,
ICRU : [5.22000,5.87400,14600.00000,428.70001,0.00350] ,
IAEA : []
},
Er : {
Z : 68 ,
A : 167.25999 ,
rho : 9.07 ,
Elast : 3.29 ,
ICRU : [5.07100,5.70600,14790.00000,433.00000,0.00341] ,
IAEA : [4.31497049,4.85346547,12995.54504003,691.00380321,0.00499022]
},
Tm : {
Z : 69 ,
A : 168.93401 ,
rho : 9.32 ,
Elast : 2.42 ,
ICRU : [4.92600,5.54200,14980.00000,433.50000,0.00334] ,
IAEA : []
},
Yb : {
Z : 70 ,
A : 173.03999 ,
rho : 6.9 ,
Elast : 1.6 ,
ICRU : [4.78800,5.38600,15170.00000,435.89999,0.00329] ,
IAEA : [6.38304258,7.21491284,12327.74719685,82.30064162,0.00516845]
},
Lu : {
Z : 71 ,
A : 174.97 ,
rho : 9.84 ,
Elast : 4.43 ,
ICRU : [4.89300,5.50500,15360.00000,438.29999,0.00324] ,
IAEA : [7.00205766,8.09268611,4589.67801229,31.06321362,0.11142124]
},
Hf : {
Z : 72 ,
A : 178.49001 ,
rho : 13.31 ,
Elast : 6.44 ,
ICRU : [5.02800,5.65700,15550.00000,440.79999,0.00320] ,
IAEA : [5.32763157,6.00140558,13853.49562768,206.93150053,0.00411522]
},
Ta : {
Z : 73 ,
A : 180.948 ,
rho : 16.65 ,
Elast : 8.1 ,
ICRU : [4.73800,5.32900,15740.00000,443.20001,0.00319] ,
IAEA : [5.15280708,5.80545310,12417.25115167,231.48549646,0.00530723]
},
W : {
Z : 74 ,
A : 183.85001 ,
rho : 19.35 ,
Elast : 8.9 ,
ICRU : [4.58700,5.16000,15410.00000,415.29999,0.00341] ,
IAEA : [4.81261962,5.41579909,15245.84079976,286.09077182,0.00344862]
},
Re : {
Z : 75 ,
A : 186.2 ,
rho : 21.04 ,
Elast : 8.03 ,
ICRU : [5.20100,5.85100,16120.00000,441.60001,0.00312] ,
IAEA : [4.26021967,4.80273372,3191.05524918,76051.48730893,0.00003161]
},
Os : {
Z : 76 ,
A : 190.2 ,
rho : 22.6 ,
Elast : 8.17 ,
ICRU : [5.07100,5.70400,16300.00000,440.89999,0.00308] ,
IAEA : []
},
Ir : {
Z : 77 ,
A : 192.2 ,
rho : 22.4 ,
Elast : 6.94 ,
ICRU : [4.94600,5.56300,16490.00000,440.10001,0.00296] ,
IAEA : [4.16543126,4.68849191,6887.94139926,4263.90641919,0.00000004]
},
Pt : {
Z : 78 ,
A : 195.09 ,
rho : 21.45 ,
Elast : 5.84 ,
ICRU : [4.47700,5.03400,16670.00000,439.29999,0.00287] ,
IAEA : [4.62228847,5.20033612,16308.49878855,266.02263275,0.00309560]
},
Au : {
Z : 79 ,
A : 196.967 ,
rho : 19.32 ,
Elast : 3.81 ,
ICRU : [4.84400,5.45800,7852.00000,975.79999,0.02077] ,
IAEA : [4.84253074,5.44769072,15602.21662947,412.25485588,0.00331383]
},
Hg : {
Z : 80 ,
A : 200.59 ,
rho : 13.55 ,
Elast : 0.67 ,
ICRU : [4.30700,4.84300,17040.00000,487.79999,0.00288] ,
IAEA : []
},
Tl : {
Z : 81 ,
A : 204.37 ,
rho : 11.85 ,
Elast : 1.88 ,
ICRU : [4.72300,5.31100,17220.00000,537.00000,0.00291] ,
IAEA : []
},
Pb : {
Z : 82 ,
A : 207.19 ,
rho : 11.35 ,
Elast : 2.03 ,
ICRU : [5.31900,5.98200,17400.00000,586.29999,0.00287] ,
IAEA : [9.42473604,17.46235676,11946.86905435,0.00000001,0.00652912]
},
Bi : {
Z : 83 ,
A : 208.98 ,
rho : 9.75 ,
Elast : 2.18 ,
ICRU : [5.95600,6.70000,17800.00000,677.00000,0.00266] ,
IAEA : [10.25823796,12.26670424,7765.05387481,7.37274504,0.02310050]
},
Po : {
Z : 84 ,
A : 210 ,
rho : 9.3 ,
Elast : 1.5 ,
ICRU : [6.15800,6.92800,17770.00000,586.29999,0.00281] ,
IAEA : []
},
At : {
Z : 85 ,
A : 210 ,
rho : 0 ,
Elast : 0.1 ,
ICRU : [6.20300,6.97900,17950.00000,586.29999,0.00278] ,
IAEA : []
},
Rn : {
Z : 86 ,
A : 222 ,
rho : 0 ,
Elast : 0.2 ,
ICRU : [6.18100,6.95400,18120.00000,586.29999,0.00275] ,
IAEA : []
},
Fr : {
Z : 87 ,
A : 223 ,
rho : 0 ,
Elast : 0.1 ,
ICRU : [6.94900,7.82000,18300.00000,586.29999,0.00274] ,
IAEA : []
},
Ra : {
Z : 88 ,
A : 226 ,
rho : 0 ,
Elast : 1.66 ,
ICRU : [7.50600,8.44800,18480.00000,586.29999,0.00273] ,
IAEA : []
},
Ac : {
Z : 89 ,
A : 227 ,
rho : 0 ,
Elast : 4.25 ,
ICRU : [7.64800,8.60900,18660.00000,586.29999,0.00270] ,
IAEA : []
},
Th : {
Z : 90 ,
A : 232.03799 ,
rho : 11.72 ,
Elast : 6.2 ,
ICRU : [7.71100,8.67900,18830.00000,586.29999,0.00264] ,
IAEA : []
},
Pa : {
Z : 91 ,
A : 231 ,
rho : 15.4 ,
Elast : 0.1 ,
ICRU : [7.40700,8.33600,19010.00000,586.29999,0.00260] ,
IAEA : []
},
U : {
Z : 92 ,
A : 238.03 ,
rho : 18.95 ,
Elast : 5.55 ,
ICRU : [7.29000,8.20400,19180.00000,586.29999,0.00267] ,
IAEA : []
},
"" : {
Z : 0 ,
A : 0.0 ,
rho : 0 ,
Elast : 0 ,
ICRU : [0,0,0,0,0] ,
IAEA : []
}
};
// Extra densities
var rhos = {
"NbN":8.47,
"Bi2Se3":7.51,
"La2CuO4": 7.08,
"La1.84Sr0.16CuO4": 6.94,
"N2":1.145,
"ZnO":5.61,
"ZnSe":5.26,
"ZnS":4.09,
"ZrO":6.0,
"Gd3Ga5O12":7.08,
"MgAl2O4":3.60,
"NdGaO3":7.57,
"YAlO3":4.88,
"Y3Al5O12":4.55,
"LiF":2.60,
"CaF2":3.18,
"BaFe":4.83,
"MgF2":3.18,
"SiO2":2.65,
"TiO2":4.26,
"KTaO3":6.967,
"LaAlO3":6.70,
"Al2O3":3.98,
"SrTiO3":5.12,
"SrLaGaO4":6.389,
"SrLaAlO4":5.924,
"NbSe2":6.30,
"MgO":3.58,
"YBa2Cu3O7":6.54,
"GaAs":5.32,
"C60":1.65
function isObject(item) {
// simple object check
// https://stackoverflow.com/a/34749873
return (item && typeof item === 'object' && !Array.isArray(item));
}
// This file contains function that are generic Javascript for TrimSP
function mergeDeep(target, ...sources) {
// function for deep-merging objects
// https://stackoverflow.com/a/34749873
if (!sources.length) {
return target;
}
const source = sources.shift();
if (isObject(target) && isObject(source)) {
for (const key in source) {
if (isObject(source[key])) {
if (!target[key]) Object.assign(target, { [key]: {} });
mergeDeep(target[key], source[key]);
} else {
Object.assign(target, { [key]: source[key] });
}
}
}
return mergeDeep(target, ...sources);
}
// list of json files containing all projectile/target element data
const dataFiles = [
"./data/elements.json",
"./data/projectiles.json",
"./data/az_table.json",
"./data/icru_table.json",
"./data/iaea_table.json"
];
// empty "main" object - to be filled with *all* projectile/target data
const elemPars = {}
// loop over each json file
for (const df of dataFiles) {
// read its contents...
const data = require(df)
// ...and deep-merge them to the "main" object
mergeDeep(elemPars, data);
};
// Extra densities (i.e., for chemical compounds)
var rhos = require("./data/densities.json")
function parse_formula (mf) {
// This function takes a chemical formula and returns
@@ -861,25 +102,36 @@ function parse_formula (mf) {
return mol;
}
function StoppingCoefficients(Element,flag)
function StoppingCoefficients(Element, flag)
{
// flag = 1 prefer ICRU otherwise prefer IAEA
// Select which tabulation to use for the Varelas-Biersack parameterization
// of electronic stopping cross sections for proton-like projectiles
// implanted in elemental targets.
// Updated Anderson-Ziegler table values for hydrogen projectiles using
// up-to-date stopping data from the IAEA database (https://www-nds.iaea.org/stopping/).
// For further details on their determination, see e.g.:
// R. M. L. McFadden at al., arXiv:2212.11081 [cond-mat.supr-con]
// https://doi.org/10.48550/arXiv.2212.11081
// flag = 1: use coefficients from Anderson & Ziegler (1977).
if (flag == 1) {
return elemPars[Element].AZ;
}
if (flag || elemPars[Element].IAEA.length < 5) {
// Using stopping coefficients derived from ICRU Report 49
//return StoppingCoefficientsICRU[Element];
return elemPars[Element].ICRU;
// flag = 2: use coefficients from ICRU Report 49 (1973).
if (flag == 2) {
return elemPars[Element].ICRU;
}
// flag = 3: use coefficients from McFadden et al. (2023) and McFadden et al. (unpublished).
//
// NOTE: these values were derived from up-to-date stopping data found inthe
// IAEA's database of electronic stopping cross sections
// (https://www-nds.iaea.org/stopping/).
// For further details on their determination, see, e.g.:
// Appendix A in McFadden at al., Phys. Rev. Applied 19, 044018 (2023).
// https://doi.org/10.1103/PhysRevApplied.19.044018
if (flag == 3 && elemPars[Element].IAEA.length == 5) {
return elemPars[Element].IAEA;
// in the event that updated coefficients are unavailable for given element
// fall back to using values from ICRU Report 49
} else {
// Using stopping coefficients derived from data in the IAEA database;
// however, if they are unavailable, return those from ICRU Report 49
//return (Element in StoppingCoefficientsIAEA) ? StoppingCoefficientsIAEA[Element] : StoppingCoefficientsICRU[Element];
return elemPars[Element].IAEA;
return elemPars[Element].ICRU;
}
}
@@ -1112,8 +364,8 @@ function prep_cfg(toggle) {
All[key]= document.getElementById(key).value;
}
// Check ICRU flag, if checked use it
All["flagICRU"] = document.getElementById("flagICRU").checked;
// Get the stopping power coefficient (SPC) flag
All["flagSPC"] = document.getElementById("flagSPC").value;
// Construct full content of cfg file
TrimSPcfg = FilesSec + LayersSec + ProjSec + ScanSec;
@@ -1248,7 +500,7 @@ function CreateInpFile() {
newLayer[0] += Comp + " " + d + " " + rho + " 1 " + nEl;
for (var j=0;j<Els.length;j++) {
let El = Els[j];
let ElSTs = StoppingCoefficients(El,All["flagICRU"]);
let ElSTs = StoppingCoefficients(El, All["flagSPC"]);
// Next 11 lines depend on number of elements
newLayer[1] += elemPars[El].Z + " " ;
data/az_table.json
+830
View File
@@ -0,0 +1,830 @@
{
"H": {
"AZ": [
1.262,
1.44,
242.6,
12000.0,
0.1159
]
},
"He": {
"AZ": [
1.229,
1.397,
484.5,
5873.0,
0.05225
]
},
"Li": {
"AZ": [
1.411,
1.6,
725.6,
3013.0,
0.04578
]
},
"Be": {
"AZ": [
2.248,
2.59,
966.0,
153.8,
0.03475
]
},
"B": {
"AZ": [
2.474,
2.815,
1206.0,
1060.0,
0.02855
]
},
"C": {
"AZ": [
2.631,
2.989,
1445.0,
957.2,
0.02819
]
},
"N": {
"AZ": [
2.954,
3.35,
1683.0,
1900.0,
0.02513
]
},
"O": {
"AZ": [
2.652,
3.0,
1920.0,
2000.0,
0.0223
]
},
"F": {
"AZ": [
2.085,
2.352,
2157.0,
2634.0,
0.01816
]
},
"Ne": {
"AZ": [
1.951,
2.199,
2393.0,
2699.0,
0.01568
]
},
"Na": {
"AZ": [
2.542,
2.869,
2628.0,
1854.0,
0.01472
]
},
"Mg": {
"AZ": [
3.792,
4.293,
2862.0,
1009.0,
0.01397
]
},
"Al": {
"AZ": [
4.154,
4.739,
2766.0,
164.5,
0.01397
]
},
"Si": {
"AZ": [
4.15,
4.7,
3329.0,
550.0,
0.01321
]
},
"P": {
"AZ": [
3.232,
3.647,
3561.0,
1560.0,
0.01267
]
},
"S": {
"AZ": [
3.447,
3.891,
3792.0,
1219.0,
0.01211
]
},
"Cl": {
"AZ": [
5.047,
5.714,
4023.0,
878.6,
0.01178
]
},
"Ar": {
"AZ": [
5.731,
6.5,
4253.0,
530.0,
0.01123
]
},
"K": {
"AZ": [
5.151,
5.833,
4482.0,
545.7,
0.01129
]
},
"Ca": {
"AZ": [
5.521,
6.252,
4710.0,
553.3,
0.01112
]
},
"Sc": {
"AZ": [
5.201,
5.884,
4938.0,
560.9,
0.009995
]
},
"Ti": {
"AZ": [
4.862,
5.496,
5165.0,
568.5,
0.009474
]
},
"V": {
"AZ": [
4.48,
5.055,
5391.0,
952.3,
0.009117
]
},
"Cr": {
"AZ": [
3.983,
4.489,
5616.0,
1336.0,
0.008413
]
},
"Mn": {
"AZ": [
3.469,
3.907,
5725.0,
1461.0,
0.008829
]
},
"Fe": {
"AZ": [
3.519,
3.963,
6065.0,
1243.0,
0.007782
]
},
"Co": {
"AZ": [
3.14,
3.535,
6288.0,
1372.0,
0.007361
]
},
"Ni": {
"AZ": [
3.553,
4.004,
6205.0,
555.1,
0.008763
]
},
"Cu": {
"AZ": [
3.696,
4.175,
4673.0,
387.8,
0.02188
]
},
"Zn": {
"AZ": [
4.21,
4.75,
6953.0,
295.2,
0.006809
]
},
"Ga": {
"AZ": [
5.041,
5.697,
7173.0,
202.6,
0.006725
]
},
"Ge": {
"AZ": [
5.554,
6.3,
6496.0,
110.0,
0.009689
]
},
"As": {
"AZ": [
5.323,
6.012,
7611.0,
292.5,
0.006447
]
},
"Se": {
"AZ": [
5.874,
6.656,
7395.0,
117.5,
0.007684
]
},
"Br": {
"AZ": [
5.611,
6.335,
8046.0,
365.2,
0.006244
]
},
"Kr": {
"AZ": [
6.411,
7.25,
8262.0,
220.0,
0.006087
]
},
"Rb": {
"AZ": [
5.694,
6.429,
8478.0,
292.9,
0.006087
]
},
"Sr": {
"AZ": [
6.339,
7.159,
8693.0,
330.3,
0.006003
]
},
"Y": {
"AZ": [
6.407,
7.234,
8907.0,
367.8,
0.005889
]
},
"Zr": {
"AZ": [
6.734,
7.603,
9120.0,
405.2,
0.005765
]
},
"Nb": {
"AZ": [
6.902,
7.791,
9333.0,
442.7,
0.005587
]
},
"Mo": {
"AZ": [
6.425,
7.248,
9545.0,
480.2,
0.005367
]
},
"Tc": {
"AZ": [
6.799,
7.671,
9756.0,
517.6,
0.005315
]
},
"Ru": {
"AZ": [
6.108,
6.887,
9966.0,
555.1,
0.005151
]
},
"Rh": {
"AZ": [
5.924,
6.677,
10180.0,
592.5,
0.004919
]
},
"Pd": {
"AZ": [
5.238,
5.9,
10380.0,
630.0,
0.004758
]
},
"Ag": {
"AZ": [
5.623,
6.354,
7160.0,
337.6,
0.01394
]
},
"Cd": {
"AZ": [
5.814,
6.554,
10800.0,
355.5,
0.004626
]
},
"In": {
"AZ": [
6.23,
7.024,
11010.0,
370.9,
0.00454
]
},
"Sn": {
"AZ": [
6.41,
7.227,
11210.0,
386.4,
0.004474
]
},
"Sb": {
"AZ": [
7.5,
8.48,
8608.0,
348.0,
0.009074
]
},
"Te": {
"AZ": [
6.979,
7.871,
11620.0,
392.4,
0.004402
]
},
"I": {
"AZ": [
7.725,
8.716,
11830.0,
394.8,
0.004376
]
},
"Xe": {
"AZ": [
8.231,
9.289,
12030.0,
397.3,
0.004384
]
},
"Cs": {
"AZ": [
7.287,
8.218,
12230.0,
399.7,
0.004447
]
},
"Ba": {
"AZ": [
7.899,
8.911,
12430.0,
402.1,
0.004511
]
},
"La": {
"AZ": [
8.041,
9.071,
12630.0,
404.5,
0.00454
]
},
"Ce": {
"AZ": [
7.489,
8.444,
12830.0,
406.9,
0.00442
]
},
"Pr": {
"AZ": [
7.291,
8.219,
13030.0,
409.3,
0.004298
]
},
"Nd": {
"AZ": [
7.098,
8.0,
13230.0,
411.8,
0.004182
]
},
"Pm": {
"AZ": [
6.91,
7.786,
13430.0,
414.2,
0.004058
]
},
"Sm": {
"AZ": [
6.728,
7.58,
13620.0,
416.6,
0.003976
]
},
"Eu": {
"AZ": [
6.551,
7.38,
13820.0,
419.0,
0.003877
]
},
"Gd": {
"AZ": [
6.739,
7.592,
14020.0,
421.4,
0.003863
]
},
"Tb": {
"AZ": [
6.212,
6.996,
14210.0,
423.9,
0.003725
]
},
"Dy": {
"AZ": [
5.517,
6.21,
14400.0,
426.3,
0.003632
]
},
"Ho": {
"AZ": [
5.219,
5.874,
14600.0,
428.7,
0.003498
]
},
"Er": {
"AZ": [
5.071,
5.706,
14790.0,
433.0,
0.003405
]
},
"Tm": {
"AZ": [
4.926,
5.542,
14980.0,
433.5,
0.003342
]
},
"Yb": {
"AZ": [
4.787,
5.386,
15170.0,
435.9,
0.003292
]
},
"Lu": {
"AZ": [
4.893,
5.505,
15360.0,
438.4,
0.003243
]
},
"Hf": {
"AZ": [
5.028,
5.657,
15550.0,
440.8,
0.003195
]
},
"Ta": {
"AZ": [
4.738,
5.329,
15740.0,
443.2,
0.003186
]
},
"W": {
"AZ": [
4.574,
5.144,
15930.0,
442.4,
0.003144
]
},
"Re": {
"AZ": [
5.2,
5.851,
16120.0,
441.6,
0.003122
]
},
"Os": {
"AZ": [
5.07,
5.704,
16300.0,
440.9,
0.003082
]
},
"Ir": {
"AZ": [
4.945,
5.563,
16490.0,
440.1,
0.002965
]
},
"Pt": {
"AZ": [
4.476,
5.034,
16670.0,
439.3,
0.002871
]
},
"Au": {
"AZ": [
4.856,
5.46,
18320.0,
438.5,
0.002542
]
},
"Hg": {
"AZ": [
4.308,
4.843,
17040.0,
487.8,
0.002882
]
},
"Tl": {
"AZ": [
4.723,
5.311,
17220.0,
537.0,
0.002913
]
},
"Pb": {
"AZ": [
5.319,
5.982,
17400.0,
586.3,
0.002871
]
},
"Bi": {
"AZ": [
5.956,
6.7,
17800.0,
677.0,
0.00266
]
},
"Po": {
"AZ": [
6.158,
6.928,
17770.0,
586.3,
0.002812
]
},
"At": {
"AZ": [
6.204,
6.979,
17950.0,
586.3,
0.002776
]
},
"Rn": {
"AZ": [
6.181,
6.954,
18120.0,
586.3,
0.002748
]
},
"Fr": {
"AZ": [
6.949,
7.82,
18300.0,
586.3,
0.002737
]
},
"Ra": {
"AZ": [
7.506,
8.448,
18480.0,
586.3,
0.002727
]
},
"Ac": {
"AZ": [
7.649,
8.609,
18660.0,
586.3,
0.002697
]
},
"Th": {
"AZ": [
7.71,
8.679,
18830.0,
586.3,
0.002641
]
},
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data/densities.json
+33
View File
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data/elements.json
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data/iaea_table.json
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data/icru_table.json
+830
View File
@@ -0,0 +1,830 @@
{
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}
data/projectiles.json
+34
View File
@@ -0,0 +1,34 @@
{
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