make polycyclic notebook look a bit better

Author: jonwzheng

scripts/average_polycyclic_thermo_group_entries_for_polycyclic(PolycyclicRing).ipynb

@@ -4,14 +4,14 @@
    "cell_type": "markdown",
    "metadata": {},
    "source": [
-    "# Averag polycyclic thermo group entries for polycyclic(PolycyclicRing)\n",
+    "# Average polycyclic thermo group entries for polycyclic(PolycyclicRing)\n",
     "\n",
-    "This ipython notebook averages all not None polycyclic group entries to use as polycyclic(PolycyclicRing). Code written by Hao-Wei Pang."
+    "This ipython notebook averages all `not None` polycyclic group entries to use as `polycyclic(PolycyclicRing)`. Code written by Hao-Wei Pang."
    ]
   },
   {
    "cell_type": "code",
-   "execution_count": 70,
+   "execution_count": 1,
    "metadata": {},
    "outputs": [],
    "source": [
@@ -31,7 +31,7 @@
   },
   {
    "cell_type": "code",
-   "execution_count": 71,
+   "execution_count": 2,
    "metadata": {},
    "outputs": [],
    "source": [
@@ -49,7 +49,7 @@
   },
   {
    "cell_type": "code",
-   "execution_count": 72,
+   "execution_count": 3,
    "metadata": {},
    "outputs": [],
    "source": [
@@ -79,7 +79,7 @@
   },
   {
    "cell_type": "code",
-   "execution_count": 73,
+   "execution_count": 4,
    "metadata": {},
    "outputs": [],
    "source": [
@@ -108,7 +108,7 @@
   },
   {
    "cell_type": "code",
-   "execution_count": 74,
+   "execution_count": 5,
    "metadata": {},
    "outputs": [
     {
@@ -125,14 +125,14 @@
       "\"\"\",\n",
       "    thermo = ThermoData(\n",
       "        Tdata = ([300,400,500,600,800,1000,1500],'K'),\n",
-      "        Cpdata = ([-8.0965, -8.0273, -7.5406, -6.7245, -5.1629, -3.8514, -2.2408],'cal/(mol*K)'),\n",
-      "        H298 = (38.139,'kcal/mol'),\n",
-      "        S298 = (52.871,'cal/(mol*K)'),\n",
+      "        Cpdata = ([-8.1041, -8.0427, -7.5606, -6.7456, -5.1779, -3.8599, -2.2452],'cal/(mol*K)'),\n",
+      "        H298 = (38.215,'kcal/mol'),\n",
+      "        S298 = (52.856,'cal/(mol*K)'),\n",
       "    ),\n",
       "    shortDesc = u\"\"\"\"\"\",\n",
       "    longDesc = \n",
       "u\"\"\"\n",
-      "Averaged on 2020-06-03 using averaging_polycyclic_group_entries_for_polycyclic(PolycyclicRing).ipynb\n",
+      "Averaged on 2025-07-01 using averaging_polycyclic_group_entries_for_polycyclic(PolycyclicRing).ipynb\n",
       "\"\"\",\n",
       ")\n",
       "\n"
@@ -142,18 +142,11 @@
    "source": [
     "print(entry_block)"
    ]
-  },
-  {
-   "cell_type": "code",
-   "execution_count": null,
-   "metadata": {},
-   "outputs": [],
-   "source": []
   }
  ],
  "metadata": {
   "kernelspec": {
-   "display_name": "Python 3",
+   "display_name": "Python 3 (ipykernel)",
    "language": "python",
    "name": "python3"
   },
@@ -167,7 +160,7 @@
    "name": "python",
    "nbconvert_exporter": "python",
    "pygments_lexer": "ipython3",
-   "version": "3.7.7"
+   "version": "3.9.23"
   }
  },
  "nbformat": 4,