deploy: f3c6b01

ParticleInMultiD.html

@@ -1059,23 +1059,21 @@ <h3>Eigenvalues and Eigenfunctions for a Particle Confined to a Circular Disk<a
        <span class="sa">f</span><span class="s1">&#39; principle quantum number </span><span class="si">{</span><span class="n">n</span><span class="si">}</span><span class="s1">, and angular quantum number </span><span class="si">{</span><span class="n">l</span><span class="si">}</span><span class="s1">&#39;</span>
        <span class="sa">f</span><span class="s1">&#39; is </span><span class="si">{</span><span class="n">compute_energy_disk</span><span class="p">(</span><span class="n">n</span><span class="p">,</span><span class="w"> </span><span class="n">l</span><span class="p">,</span><span class="w"> </span><span class="n">a</span><span class="p">)</span><span class="si">:</span><span class="s1">.3f</span><span class="si">}</span><span class="s1"> a.u..&#39;</span><span class="p">)</span>
 
-
-<span class="c1">#Principle quantum number slider:</span>
-<span class="n">n</span> <span class="o">=</span> <span class="mi">1</span>
-
-<span class="c1">#Angular quantum number slider:</span>
-<span class="n">l</span> <span class="o">=</span> <span class="mi">0</span>
-
-<span class="c1">#Box length slider:</span>
-<span class="n">a</span> <span class="o">=</span> <span class="mi">1</span>
-
-
 <span class="n">print_energy_disk</span><span class="p">(</span><span class="n">a</span><span class="p">,</span> <span class="n">n</span><span class="p">,</span> <span class="n">l</span><span class="p">)</span>
 </pre></div>
 </div>
 </div>
 <div class="cell_output docutils container">
-<div class="output stream highlight-myst-ansi notranslate"><div class="highlight"><pre><span></span>The energy of an electron confined to a disk with radius 1.00 a.u., principle quantum number 1, and angular quantum number 0 is 2.892 a.u..
+<div class="output traceback highlight-ipythontb notranslate"><div class="highlight"><pre><span></span><span class="gt">---------------------------------------------------------------------------</span>
+<span class="ne">NameError</span><span class="g g-Whitespace">                                 </span>Traceback (most recent call last)
+<span class="n">Cell</span> <span class="n">In</span><span class="p">[</span><span class="mi">2</span><span class="p">],</span> <span class="n">line</span> <span class="mi">17</span>
+<span class="g g-Whitespace">     </span><span class="mi">12</span> <span class="k">def</span><span class="w"> </span><span class="nf">print_energy_disk</span><span class="p">(</span><span class="n">a</span><span class="p">,</span> <span class="n">n</span><span class="p">,</span> <span class="n">l</span><span class="p">):</span>
+<span class="g g-Whitespace">     </span><span class="mi">13</span>     <span class="nb">print</span><span class="p">(</span><span class="sa">f</span><span class="s1">&#39;The energy of an electron confined to a disk with radius </span><span class="si">{</span><span class="n">a</span><span class="si">:</span><span class="s1">.2f</span><span class="si">}</span><span class="s1"> a.u.,&#39;</span>
+<span class="g g-Whitespace">     </span><span class="mi">14</span>        <span class="sa">f</span><span class="s1">&#39; principle quantum number </span><span class="si">{</span><span class="n">n</span><span class="si">}</span><span class="s1">, and angular quantum number </span><span class="si">{</span><span class="n">l</span><span class="si">}</span><span class="s1">&#39;</span>
+<span class="g g-Whitespace">     </span><span class="mi">15</span>        <span class="sa">f</span><span class="s1">&#39; is </span><span class="si">{</span><span class="n">compute_energy_disk</span><span class="p">(</span><span class="n">n</span><span class="p">,</span><span class="w"> </span><span class="n">l</span><span class="p">,</span><span class="w"> </span><span class="n">a</span><span class="p">)</span><span class="si">:</span><span class="s1">.3f</span><span class="si">}</span><span class="s1"> a.u..&#39;</span><span class="p">)</span>
+<span class="ne">---&gt; </span><span class="mi">17</span> <span class="n">print_energy_disk</span><span class="p">(</span><span class="n">a</span><span class="p">,</span> <span class="n">n</span><span class="p">,</span> <span class="n">l</span><span class="p">)</span>
+
+<span class="ne">NameError</span>: name &#39;a&#39; is not defined
 </pre></div>
 </div>
 </div>
@@ -1322,17 +1320,6 @@ <h3>Solutions to the Schrödinger Equation for a Particle Confined to a Spherica
        <span class="sa">f</span><span class="s1">&#39; principle quantum number </span><span class="si">{</span><span class="n">n</span><span class="si">}</span><span class="s1">, and angular quantum number </span><span class="si">{</span><span class="n">l</span><span class="si">}</span><span class="s1">&#39;</span>
        <span class="sa">f</span><span class="s1">&#39; is </span><span class="si">{</span><span class="n">compute_energy_ball</span><span class="p">(</span><span class="n">n</span><span class="p">,</span><span class="w"> </span><span class="n">l</span><span class="p">,</span><span class="w"> </span><span class="n">a</span><span class="p">)</span><span class="si">:</span><span class="s1">5.2f</span><span class="si">}</span><span class="s1"> a.u..&#39;</span><span class="p">)</span>
 
-
-<span class="c1">#Principle quantum number slider:</span>
-<span class="n">n</span> <span class="o">=</span> <span class="mi">1</span>
-
-<span class="c1">#Angular quantum number slider:</span>
-<span class="n">l</span> <span class="o">=</span> <span class="mi">0</span>
-
-<span class="c1">#Box length slider:</span>
-<span class="n">a</span> <span class="o">=</span> <span class="mi">1</span>
-
-
 <span class="n">print_energy_ball</span><span class="p">(</span><span class="n">a</span><span class="p">,</span> <span class="n">n</span><span class="p">,</span> <span class="n">l</span><span class="p">)</span>
 </pre></div>
 </div>

_sources/ParticleInMultiD.ipynb

@@ -665,17 +665,6 @@
     "       f' principle quantum number {n}, and angular quantum number {l}'\n",
     "       f' is {compute_energy_disk(n, l, a):.3f} a.u..')\n",
     "\n",
-    "\n",
-    "#Principle quantum number slider:\n",
-    "n = 1\n",
-    "\n",
-    "#Angular quantum number slider:\n",
-    "l = 0\n",
-    "\n",
-    "#Box length slider:\n",
-    "a = 1\n",
-    "\n",
-    "\n",
     "print_energy_disk(a, n, l)"
    ]
   },
@@ -999,17 +988,6 @@
     "       f' principle quantum number {n}, and angular quantum number {l}'\n",
     "       f' is {compute_energy_ball(n, l, a):5.2f} a.u..')\n",
     "\n",
-    "\n",
-    "#Principle quantum number slider:\n",
-    "n = 1\n",
-    "\n",
-    "#Angular quantum number slider:\n",
-    "l = 0\n",
-    "\n",
-    "#Box length slider:\n",
-    "a = 1\n",
-    "\n",
-    "\n",
     "print_energy_ball(a, n, l)"
    ]
   },

reports/ParticleInMultiD.err.log

@@ -0,0 +1,51 @@
+Traceback (most recent call last):
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/site-packages/jupyter_cache/executors/utils.py", line 58, in single_nb_execution
+    executenb(
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/site-packages/nbclient/client.py", line 1319, in execute
+    return NotebookClient(nb=nb, resources=resources, km=km, **kwargs).execute()
+           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/site-packages/jupyter_core/utils/__init__.py", line 165, in wrapped
+    return loop.run_until_complete(inner)
+           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/asyncio/base_events.py", line 654, in run_until_complete
+    return future.result()
+           ^^^^^^^^^^^^^^^
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/site-packages/nbclient/client.py", line 709, in async_execute
+    await self.async_execute_cell(
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/site-packages/nbclient/client.py", line 1062, in async_execute_cell
+    await self._check_raise_for_error(cell, cell_index, exec_reply)
+  File "/opt/hostedtoolcache/Python/3.11.11/x64/lib/python3.11/site-packages/nbclient/client.py", line 918, in _check_raise_for_error
+    raise CellExecutionError.from_cell_and_msg(cell, exec_reply_content)
+nbclient.exceptions.CellExecutionError: An error occurred while executing the following cell:
+------------------
+# Define a function for the energy (in a.u.) of a particle in a circular disk
+# with length a, principle quantum number n, and angular quantum number l
+# The length is input in Bohr (atomic units).
+def compute_energy_disk(n, l, a):
+    "Compute 1-dimensional particle-in-a-spherical-ball energy."
+    #Compute the first n zeros of the Bessel function
+    zeros = special.jn_zeros(l,n)
+    #Compute the energy from the n-th zero.
+    return  (zeros[-1])**2/ (2 * a**2)
+
+#This next bit of code just prints out the energy in atomic units
+def print_energy_disk(a, n, l):
+    print(f'The energy of an electron confined to a disk with radius {a:.2f} a.u.,'
+       f' principle quantum number {n}, and angular quantum number {l}'
+       f' is {compute_energy_disk(n, l, a):.3f} a.u..')
+
+print_energy_disk(a, n, l)
+------------------
+
+
+---------------------------------------------------------------------------
+NameError                                 Traceback (most recent call last)
+Cell In[2], line 17
+     12 def print_energy_disk(a, n, l):
+     13     print(f'The energy of an electron confined to a disk with radius {a:.2f} a.u.,'
+     14        f' principle quantum number {n}, and angular quantum number {l}'
+     15        f' is {compute_energy_disk(n, l, a):.3f} a.u..')
+---> 17 print_energy_disk(a, n, l)
+
+NameError: name 'a' is not defined
+