From 73327b46e69a1734e4afcf1c253836f969e96098 Mon Sep 17 00:00:00 2001
From: Ian Bell <ian.bell@nist.gov>
Date: Tue, 15 Nov 2022 15:56:08 -0700
Subject: [PATCH] More for model potentials
---
doc/source/models/model_potentials.ipynb | 22 ++++++++++++++++++----
1 file changed, 18 insertions(+), 4 deletions(-)
diff --git a/doc/source/models/model_potentials.ipynb b/doc/source/models/model_potentials.ipynb
index c0c400f..b63c98e 100644
--- a/doc/source/models/model_potentials.ipynb
+++ b/doc/source/models/model_potentials.ipynb
@@ -26,7 +26,19 @@
"id": "bf22ac3d",
"metadata": {},
"source": [
- "# Square-well"
+ "## Square-well\n",
+ "\n",
+ "The potential is defined by\n",
+ "\n",
+ "$\n",
+ "V(r) = \\left\\lbrace \\begin{array}{cc}\n",
+ " \\infty & r < \\sigma \\\\\n",
+ " -\\varepsilon & \\sigma < r < \\lambda\\sigma \\\\\n",
+ " 0 & r > \\lambda \\sigma\n",
+ " \\end{array}\\right. \n",
+ "$\n",
+ "\n",
+ "from which an EOS can be developed by correlating results from molecular simulation."
]
},
{
@@ -50,7 +62,7 @@
"id": "f0caf9ea",
"metadata": {},
"source": [
- "# EXP-6"
+ "## EXP-6"
]
},
{
@@ -74,7 +86,9 @@
"id": "b87cbd05",
"metadata": {},
"source": [
- "# Lennard-Jones Fluid"
+ "## Lennard-Jones Fluid\n",
+ "\n",
+ "The EOS for Lennard-Jones is that from Thol et al."
]
},
{
@@ -96,7 +110,7 @@
"id": "fad87158",
"metadata": {},
"source": [
- "# Two-Center Lennard-Jones Fluid"
+ "## Two-Center Lennard-Jones Fluid"
]
},
{
--
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