How to run a L-W1X calculation with ORCA
To download a script for running a L-W1X calculation with ORCA go to: https://github.com/armanderch/l-w1x For further details about L-W1X theory see: B. Chan, A. Karton, J. Comput. Chem. 2022, 43, 1394. https://doi.org/10.1002/jcc.26892 [Download PDF]