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grimme-lab · Nov 24, 2022 · 50e2473 · 50e2473
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+# ORCA4wB97X-3c
+Fortran script for setting up a wB97X-3c calculation with ORCA.
+
+To set up an input file for wB97X-3c, you have to execute the binary in a directory with a 'coord' file.
+
+See the "-help" flag for further possibilities.
+
+WARNING: Due to the use of a deprecated I/O routine, the use of 'coord' files with scientific notation is not possible.