Reference Label | Details |
---|---|
est unc | estimated uncertainty |
De Fazio 2012 | D. De Fazio, M. de Castro-Vitores, A. Aguado, V. Aquilanti, and S. Cavalli, J. Chem. Phys. 137, 244306/1-14 (2012) The He + H2+ = HeH+ + H Reaction: Ab initio Studies of the Potential Energy Surface, Benchmark Time-Independent Quantum Dynamics in an Extended Energy Range and Comparison with Experiments |
Papp 2017 | D. Papp, T. Szidarovszky, and A. G. Császár, J. Chem. Phys. 147, 094106/1-12 (2017) A General Variational Approach for Computing Rovibrational Resonances of Polyatomic Molecules. Application to the Weakly Bound H2He+ and H2-CO Systems |
Papp 2018 | D. Papp, A. G. Császár, K. Yamanouchi, and T. Szidarovszky, J. Chem. Theory Comput. 14, 1523-1533 (2018) Rovibrational Resonances in H2He+ |