Absorption / MD / Cumulant Test #8

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1. ChristopherAMyers

   added this to the MD Absorption Test Set milestone on Jul 1, 2023
2. ChristopherAMyers commented on Jul 17, 2023

   

   ChristopherAMyers

   on Jul 17, 2023

   Last edited by ChristopherAMyers

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   We need a Herzberg-Teller compatible trajectory dataset in order to add HT tests. The current test set is using the PYP trajectory from the examples, but this has only two columns for energy and oscillator strength only.

   The tests for linear absorption with 2nd and 3rd order cumulant are other wise done