set T_init to T_nvt when not given in nvt example

general-molecular-simulations · Oct 9, 2024 · e6ac3df · e6ac3df
1 parent 98509d0
commit e6ac3df
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/examples/nvt_jaxmd.ipynb b/examples/nvt_jaxmd.ipynb
@@ -356,7 +356,7 @@
     "\n",
     "# Set the temprature at initialization\n",
     "if T_init is None:\n",
-    "    T_init = float(T_nvt / nvt_cycles) \n",
+    "    T_init = T_nvt \n",
     "else:\n",
     "    T_init = T_init\n",
     "\n",