As a first challenge, the QTSH method should be applied to the superexchange example from the paper by Prezhdo and coworkers. The intriguing question is whether the new QTSH implementation in WavePacket will yield the same result as C. C. Martens' previous QTSH implementation in Fortran, see figure 5 of his paper published in 2019.
Im Anhang sind die veränderte Dateien, die wir am Donnerstag benutzt haben.