ORCA Tutorial | How to Make ORCA Input Files and Read Output Files
12:31
YouTubeWisdom Center
ORCA Tutorial | How to Make ORCA Input Files and Read Output Files
In this ORCA tutorial, I show you how to create ORCA input files using a simple text editor when you already have the XYZ coordinates of your molecule. You’ll learn how to correctly format the input file, specify calculation parameters, and prepare it for use with the ORCA quantum chemistry package. I also explain how to read ORCA output ...
6.6K viewsNov 6, 2021
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