From 3e1e71a493313bd96b7c6092ccce9c7ddbffb565 Mon Sep 17 00:00:00 2001
From: MatiasJJ <39948154+MatiasJJ@users.noreply.github.com>
Date: Thu, 27 Apr 2023 14:30:21 +0300
Subject: [PATCH 1/2] Added filenames in the instructions

Of course they don't match if someone changes their file names.
---
 vib/README.md | 2 ++
 1 file changed, 2 insertions(+)

diff --git a/vib/README.md b/vib/README.md
index 84c9d74..fe76e61 100644
--- a/vib/README.md
+++ b/vib/README.md
@@ -12,6 +12,8 @@ frequently used to verify that a TS was really found.
    wave function restart there and edit the input files (replace `TODO`):
    * Fix coordinate and wavefunction restart filenames
    * The initial density guess (`SCF_GUESS`) is made based on `RESTART`
+   * The wave-function file from earlier calculation (`WFN_NAME`) should be `enol-neb-BAND5-RESTART.wfn`
+   * Coordinates-file from earlier calculation (`XYZ_NAME`) should be `enol-neb-pos-Replica_nr_5-1.xyz`
    * `RUN_TYPE` should be `VIBRATIONAL_ANALYSIS`
 
    ```bash

From 859ae4d238f4649506969681611c2ed34912b36e Mon Sep 17 00:00:00 2001
From: MatiasJJ <39948154+MatiasJJ@users.noreply.github.com>
Date: Thu, 27 Apr 2023 14:42:11 +0300
Subject: [PATCH 2/2] added extra golden visualisation

---
 vib/README.md | 7 +++++++
 1 file changed, 7 insertions(+)

diff --git a/vib/README.md b/vib/README.md
index fe76e61..fa13bae 100644
--- a/vib/README.md
+++ b/vib/README.md
@@ -34,4 +34,11 @@ frequently used to verify that a TS was really found.
    are there in total? Why?
    * Hint: Think about degrees of freedom
 
+Extra: Visualise the vibrations with Molden:
+
+   ```bash
+   $ module load molden
+   $ molden enol-vib-VIBRATIONS-1.mol
+   ```
+
 **Continue the hands-on with [Part 3](../hybrid/README.md).**