Publications

Jan Sielk, H. Frank Von Horsten, Bernd Hartke, and Guntram Rauhut. Towards automated multi-dimensional quantum dynamical investigations of double-minimum potentials: Principles and example applications. Chem. Phys., (380)1-3:1–8, February 2011. [PUMA: expansion,Potential theoretische stuttgart surface,Quantum-mechanical chemie energy from:alexanderdenzel dynamics rauhut wavepacket calculations,Many-coordinate Ab-initio theochem] URL