added 30keV sample

This commit is contained in:
swim committed 2026-07-26 16:04:18 +09:00
1 parent 64134dd468
commit 1bcb9014dd
1 file changed
+145 -214
@@ -17,7 +17,6 @@
"from scipy.ndimage import gaussian_filter\n", "from scipy.ndimage import gaussian_filter\n",
"from scipy.optimize import curve_fit\n", "from scipy.optimize import curve_fit\n",
"from scipy.special import erf\n", "from scipy.special import erf\n",
"# from scipy.stats import norm\n",
"\n", "\n",
"import kemstem" "import kemstem"
] ]
@@ -65,6 +64,7 @@
" '2V': loadmat('./Si2V1-Niter1000.mat'),\n", " '2V': loadmat('./Si2V1-Niter1000.mat'),\n",
" '5V': loadmat('./Si5V2-Niter1000.mat'),\n", " '5V': loadmat('./Si5V2-Niter1000.mat'),\n",
" '8V': loadmat('./Si8V2-Niter1000.mat'),\n", " '8V': loadmat('./Si8V2-Niter1000.mat'),\n",
" '30V': loadmat('./Si30V3-Niter1000.mat'),\n",
"}" "}"
] ]
}, },
@@ -117,7 +117,7 @@
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"version_minor": 0 "version_minor": 0
}, },
@@ -131,7 +131,7 @@
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@@ -145,7 +145,7 @@
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@@ -155,6 +155,20 @@
}, },
"metadata": {}, "metadata": {},
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},
{
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"text/plain": [
" 0%| | 0/1014 [00:00<?, ?it/s]"
]
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"source": [ "source": [
@@ -179,13 +193,13 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": null, "execution_count": 7,
"id": "4925866a", "id": "4925866a",
"metadata": {}, "metadata": {},
"outputs": [], "outputs": [],
"source": [ "source": [
"# def double_erf(x, p, q, x0, x1):\n", "def double_erf(x, p, q, x0, x1):\n",
"# return p * (erf(q*(x - x0)) - erf(q*(x - x1)))\n", " return p * (erf(q*(x - x0)) - erf(q*(x - x1)))\n",
"\n", "\n",
"def double_erf_plus_const(x, p0, p1, q, x0, x1):\n", "def double_erf_plus_const(x, p0, p1, q, x0, x1):\n",
" return p0 + double_erf(x, p1, q, x0, x1)" " return p0 + double_erf(x, p1, q, x0, x1)"
@@ -193,14 +207,14 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": null, "execution_count": 8,
"id": "62a285a5", "id": "62a285a5",
"metadata": {}, "metadata": {},
"outputs": [ "outputs": [
{ {
"data": { "data": {
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"model_id": "6885a55998954f73ba1679a126d1e2a7", "model_id": "2759b336195e4062b4bd09aef23d3346",
"version_major": 2, "version_major": 2,
"version_minor": 0 "version_minor": 0
}, },
@@ -214,7 +228,7 @@
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"version_major": 2, "version_major": 2,
"version_minor": 0 "version_minor": 0
}, },
@@ -228,7 +242,7 @@
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"version_major": 2, "version_major": 2,
"version_minor": 0 "version_minor": 0
}, },
@@ -238,12 +252,25 @@
}, },
"metadata": {}, "metadata": {},
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},
{
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"version_major": 2,
"version_minor": 0
},
"text/plain": [
" 0%| | 0/1014 [00:00<?, ?it/s]"
]
},
"metadata": {},
"output_type": "display_data"
} }
], ],
"source": [ "source": [
"crystalline_heights = {}\n", "crystalline_heights = {}\n",
"crystalline_height_errs = {}\n", "crystalline_height_errs = {}\n",
"safe_height_indices = {}\n",
"\n", "\n",
"for key in results.keys():\n", "for key in results.keys():\n",
"\n", "\n",
@@ -255,13 +282,13 @@
"\n", "\n",
" for column in tqdm(columns):\n", " for column in tqdm(columns):\n",
" popt, perr, _ = fit(\n", " popt, perr, _ = fit(\n",
" double_erf_plus_const, np.arange(len(column)), column, plot=False,\n", " double_erf, np.arange(len(column)), column, plot=False,\n",
" p0=[-0.03846732, 0.28181914, 0.30406586, 3.74047066, 12.6762897 ],\n", " p0=[0.1, 0.3, 3, 12],\n",
" # bounds=bounds,\n", " # bounds=bounds,\n",
" maxfev=10000\n", " maxfev=10000\n",
" )\n", " )\n",
" p0, p1, q, x0, x1 = popt\n", " p1, q, x0, x1 = popt\n",
" dp0, dp1, dq, dx0, dx1 = perr\n", " dp1, dq, dx0, dx1 = perr\n",
"\n", "\n",
" crystalline.append((x1 - x0) * dz)\n", " crystalline.append((x1 - x0) * dz)\n",
" crystalline_err.append(dz * (dx0 + dx1) / 2)\n", " crystalline_err.append(dz * (dx0 + dx1) / 2)\n",
@@ -272,91 +299,25 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 16, "execution_count": 9,
"id": "6af86cf4", "id": "6af86cf4",
"metadata": {}, "metadata": {},
"outputs": [ "outputs": [],
{
"data": {
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truncated
"text/plain": [
"<Figure size 640x480 with 1 Axes>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"name": "stdout",
"output_type": "stream",
"text": [
"281.0 64.3051954434194\n"
]
},
{
"data": {
"image/png": 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truncated
"text/plain": [
"<Figure size 640x480 with 1 Axes>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"name": "stdout",
"output_type": "stream",
"text": [
"336.0 74.10726414958422\n"
]
}
],
"source": [ "source": [
"safe_height_indices = {}\n",
"\n",
"for key in results.keys():\n", "for key in results.keys():\n",
" crystalline = crystalline_heights[key]\n", " crystalline = crystalline_heights[key]\n",
" crystalline_err = crystalline_height_errs[key]\n", " crystalline_err = crystalline_height_errs[key]\n",
" sorted_heights = np.sort(crystalline)\n",
"\n", "\n",
" safe_height_index = np.where(\n", " safe_height_index = np.where(crystalline_err < crystalline / 10)\n",
" # (crystalline > ymin) & (crystalline < ymax)\n", " # safe_height_index = np.where(crystalline)\n",
" crystalline_err < crystalline / 10\n", " safe_height_indices.update({key: safe_height_index})"
" )\n",
"\n",
" # ymin = sorted_heights[1 * len(sorted_heights) // 20]\n",
" # ymax = sorted_heights[19 * len(sorted_heights) // 20]\n",
"\n",
" plt.plot(sorted_heights[safe_height_index], 'k.')\n",
" # xlim = plt.xlim(0, len(crystalline))\n",
" # ylim = plt.ylim(ymin, ymax)\n",
" plt.show()\n",
"\n",
" safe_height_indices.update({key: safe_height_index})\n",
"\n",
" total_thickness = recons[key].shape[-1] * DZ[key]\n",
"\n",
" print(total_thickness, (total_thickness - np.median(crystalline)) / 2)"
] ]
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 17, "execution_count": 10,
"id": "8cfc6801", "id": "8cfc6801",
"metadata": {}, "metadata": {},
"outputs": [ "outputs": [
@@ -372,7 +333,10 @@
"[72, 217, 362, 507]\n", "[72, 217, 362, 507]\n",
"8V\n", "8V\n",
"(581, 581)\n", "(581, 581)\n",
"[72, 217, 363, 508]\n" "[72, 217, 363, 508]\n",
"30V\n",
"(541, 541)\n",
"[67, 202, 338, 473]\n"
] ]
} }
], ],
@@ -385,40 +349,22 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 19, "execution_count": 11,
"id": "9f30bf4b", "id": "9f30bf4b",
"metadata": {}, "metadata": {},
"outputs": [], "outputs": [],
"source": [ "source": [
"thickness_rois = {\n", "thickness_rois = {\n",
" '2V': [[214, 358], [214, 358]],\n", " '2V' : [[214, 358], [214, 358]],\n",
" '5V': [[217, 362], [ 72, 217]],\n", " '5V' : [[217, 362], [ 72, 217]],\n",
" '8V': [[217, 363], [ 72, 217]]\n", " '8V' : [[217, 363], [ 72, 217]],\n",
"}\n", " '30V': [[338, 473], [ 202, 338]]\n",
"# for key in results.keys():\n", "}"
"\n",
"# recon = recons[key]\n",
"# heights = crystalline_heights[key]\n",
"# c0 = column_positions[key]\n",
"# idx = safe_height_indices[key]\n",
"# dz = DZ[key]\n",
"\n",
"# plt.imshow(np.angle(recon).sum(axis=-1), cmap='gray')\n",
"# # plt.axis('off')\n",
"# plt.scatter(\n",
"# c0[:, 1][idx], c0[:, 0][idx], c=np.array(heights[idx]), s=8, cmap='magma_r',\n",
"# )\n",
"# cbar = plt.colorbar()\n",
"\n",
"# (x0, x1), (y0, y1) = thickness_rois[key]\n",
"# plt.plot([x0, x0, x1, x1, x0], [y0, y1, y1, y0, y0], lw=3)\n",
"\n",
"# plt.show()\n"
] ]
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 20, "execution_count": 12,
"id": "8f03ee83", "id": "8f03ee83",
"metadata": {}, "metadata": {},
"outputs": [], "outputs": [],
@@ -438,7 +384,7 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 21, "execution_count": 13,
"id": "45bba998", "id": "45bba998",
"metadata": {}, "metadata": {},
"outputs": [], "outputs": [],
@@ -471,37 +417,37 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 22, "execution_count": 14,
"id": "ddbd2457", "id": "f61e53da",
"metadata": {}, "metadata": {},
"outputs": [ "outputs": [],
{
"data": {
"text/plain": [
"array([ 4, 16, 61, 72, 75, 77, 84, 92, 103, 119, 123,\n",
" 142, 157, 173, 174, 185, 202, 209, 240, 245, 253, 259,\n",
" 273, 302, 314, 323, 325, 328, 330, 333, 359, 369, 385,\n",
" 391, 396, 418, 448, 487, 494, 515, 518, 528, 539, 554,\n",
" 556, 560, 594, 601, 602, 607, 616, 631, 657, 668, 693,\n",
" 706, 722, 741, 747, 782, 787, 793, 801, 814, 831, 841,\n",
" 854, 861, 865, 873, 877, 896, 910, 921, 926, 929, 942,\n",
" 945, 952, 977, 981, 990, 1006, 1010, 1011, 1013, 1019, 1060,\n",
" 1076, 1081, 1096, 1102, 1121, 1135, 1177, 1185, 1212, 1224, 1235,\n",
" 1244, 1275, 1291])"
]
},
"execution_count": 22,
"metadata": {},
"output_type": "execute_result"
}
],
"source": [ "source": [
"roi_indices['2V'][0][0]" "# idx = np.where(crystalline_height_errs['2V'] > crystalline_heights['2V'] / 10)[0]\n",
"\n",
"# if input(len(idx)) == 'y': pass\n",
"\n",
"# for i in idx[::10]:\n",
"# c = column_lists['2V'][i]\n",
"# z = np.arange(len(c)) * DZ['2V']\n",
"\n",
"# popt, perr, _ = fit(\n",
"# double_erf, np.arange(len(c)), c, plot=True,\n",
"# p0=[0.28181914, 0.30406586, 3.74047066, 12.6762897],\n",
"# # bounds=bounds,\n",
"# maxfev=10000\n",
"# )\n",
" \n",
"# p1, q, x0, x1 = popt\n",
"# dp1, dq, dx0, dx1 = perr\n",
"\n",
"# print((x1 - x0) * dz, dz * (dx0 + dx1) / 2, (dz * (dx0 + dx1) / 2) / (x1 - x0) * dz)\n",
"\n",
"# plt.show()"
] ]
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": 23, "execution_count": 15,
"id": "d0926668", "id": "d0926668",
"metadata": {}, "metadata": {},
"outputs": [ "outputs": [
@@ -510,14 +456,14 @@
"output_type": "stream", "output_type": "stream",
"text": [ "text": [
"2V\n", "2V\n",
"Crystalline thickness: 165.816 ± 13.289\n", "Crystalline thickness: 179.520 ± 11.576\n",
"Amorphous thickness: 39.592 ± 6.645\n", "Amorphous thickness: 32.740 ± 5.788\n",
"(# of counted columns = 83/102)\n" "(# of counted columns = 99/102)\n"
] ]
}, },
{ {
"data": { "data": {
"image/png": 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truncated "image/png": 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truncated
"text/plain": [ "text/plain": [
"<Figure size 640x480 with 1 Axes>" "<Figure size 640x480 with 1 Axes>"
] ]
@@ -530,14 +476,14 @@
"output_type": "stream", "output_type": "stream",
"text": [ "text": [
"5V\n", "5V\n",
"Crystalline thickness: 154.896 ± 11.639\n", "Crystalline thickness: 159.217 ± 11.446\n",
"Amorphous thickness: 63.052 ± 5.820\n", "Amorphous thickness: 60.891 ± 5.723\n",
"(# of counted columns = 106/106)\n" "(# of counted columns = 106/106)\n"
] ]
}, },
{ {
"data": { "data": {
"image/png": 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truncated
"text/plain": [ "text/plain": [
"<Figure size 640x480 with 1 Axes>" "<Figure size 640x480 with 1 Axes>"
] ]
@@ -550,14 +496,34 @@
"output_type": "stream", "output_type": "stream",
"text": [ "text": [
"8V\n", "8V\n",
"Crystalline thickness: 192.238 ± 13.491\n", "Crystalline thickness: 185.428 ± 10.826\n",
"Amorphous thickness: 71.881 ± 6.745\n", "Amorphous thickness: 75.286 ± 5.413\n",
"(# of counted columns = 118/118)\n" "(# of counted columns = 118/118)\n"
] ]
}, },
{ {
"data": { "data": {
"image/png": 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truncated "image/png": 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truncated
"text/plain": [
"<Figure size 640x480 with 1 Axes>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"name": "stdout",
"output_type": "stream",
"text": [
"30V\n",
"Crystalline thickness: 156.487 ± 19.781\n",
"Amorphous thickness: 261.757 ± 9.891\n",
"(# of counted columns = 45/101)\n"
]
},
{
"data": {
"image/png": 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truncated
"text/plain": [ "text/plain": [
"<Figure size 640x480 with 1 Axes>" "<Figure size 640x480 with 1 Axes>"
] ]
@@ -604,43 +570,25 @@
}, },
{ {
"cell_type": "code", "cell_type": "code",
"execution_count": null, "execution_count": 16,
"id": "0d23f0b2", "id": "9701672b",
"metadata": {},
"outputs": [],
"source": []
},
{
"cell_type": "code",
"execution_count": null,
"id": "d59fd141",
"metadata": {}, "metadata": {},
"outputs": [ "outputs": [
{ {
"data": { "data": {
"image/png": 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truncated
"text/plain": [ "text/plain": [
"<Figure size 640x480 with 1 Axes>" "<matplotlib.legend.Legend at 0x7f062a5eed80>"
] ]
}, },
"execution_count": 16,
"metadata": {}, "metadata": {},
"output_type": "display_data" "output_type": "execute_result"
}, },
{ {
"data": { "data": {
"image/png": 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truncated
"text/plain": [ "text/plain": [
"<Figure size 640x480 with 1 Axes>" "<Figure size 900x900 with 1 Axes>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"image/png": 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truncated
"text/plain": [
"<Figure size 640x480 with 1 Axes>"
] ]
}, },
"metadata": {}, "metadata": {},
@@ -648,50 +596,33 @@
} }
], ],
"source": [ "source": [
"voltages = []\n",
"damage = []\n",
"damage_err = []\n",
"\n",
"for key in results.keys():\n", "for key in results.keys():\n",
" voltages.append(float(key[:-1]))\n",
" damage.append(roi_amorphous_height_means[key])\n",
" damage_err.append(roi_amorphous_height_stds[key])\n",
"\n", "\n",
" recon = recons[key]\n", "plt.figure(figsize=(3, 3), dpi=300)\n",
" heights = crystalline_heights[key]\n",
" c0 = column_positions[key]\n",
"\n", "\n",
" top = tops[key]\n", "plt.errorbar(voltages, damage, damage_err,\n",
" middle = middles[key]\n", " fmt=\"o\", capsize=3, capthick=1, label=\"Current study\",\n",
" bottom = bottoms[key]\n", " zorder=100, color='k'\n",
" top_std = top_stds[key]\n",
" middle_std = middle_stds[key]\n",
" bottom_std = bottom_stds[key]\n",
"\n",
" plt.imshow(np.angle(recon).sum(axis=-1), cmap='gray')\n",
"\n",
" for i, roi in enumerate(thickness_rois[key]):\n",
"\n",
" idx = roi_indices[key][i]\n",
"\n",
" (x0, x1), (y0, y1) = roi\n",
" plt.plot([x0, x0, x1, x1, x0], [y0, y1, y1, y0, y0], lw=3)\n",
" plt.text(x1+5, y1-10, f\"{middle[i]:.2f} ± {middle_std[i]:.2f}\", color='white')\n",
"\n",
" sorted_heights = np.sort(heights)\n",
"\n",
" # plt.axis('off')\n",
" plt.scatter(\n",
" c0[:, 1][idx], c0[:, 0][idx], c=np.array(heights)[idx], s=8, cmap='magma_r',\n",
" vmax=sorted_heights[-30], \n",
" vmin=sorted_heights[30]\n",
" )\n", " )\n",
" # cbar = plt.colorbar()\n", "plt.plot([30, 8, 5, 2], [220, 70, 40, 10], '*', label='Uzuhashi et al. (2024)\\n(Amorphous)')\n",
"plt.plot([30, 8, 5, 2], [290, 100, 70, 70], 'p', label='Uzuhashi et al. (2024)\\n(Total damage)')\n",
"plt.plot([30, 5, 2], [220, 66, 31], 's', label='Burnett et al. (2015)')\n",
"plt.plot([30, 5, 2], [220, 25, 10], 'v', label='Mayer et al. (2007)')\n",
"plt.plot([30, 5, 2], [210, 20, 10], '<', label='Giannuzzi et al. (2005)')\n",
"plt.plot([30, 10], [200, 100], '>', label='Kato et al. (1999)')\n",
"\n", "\n",
"plt.xlabel(\"FIB voltage [keV]\")\n",
"plt.ylabel(\"Si damage [Å]\")\n",
"\n", "\n",
" plt.show()\n" "plt.legend(fontsize=7)"
] ]
},
{
"cell_type": "code",
"execution_count": null,
"id": "0726cc98",
"metadata": {},
"outputs": [],
"source": []
} }
], ],
"metadata": { "metadata": {