[1] A.
G. Császár and T. Furtenbacher, Promoting and Inhibiting Tunneling via
Nuclear Motions, Phys. Chem. Chem. Phys. 2016, 18,
1092-1104. http://dx.doi.org/10.1039/c5cp04270d PDF (3577 kB)
[2] P. Árendás, T. Furtenbacher, and A. G. Császár, On Spectra of Spectra, J. Math. Chem. 2016, 54,
806-822. http://dx.doi.org/10.1007/s10910-016-0591-1
PDF (1065 kB)
[3] A. G. Császár, G. Chambaud, R.
Linguerri, and M. Hochlaf, Les mouvements des molécules: des outils en développement pour explorer la
matičre, Act. Chim. J.
2016, 404, 22-27. PDF (1390
kB).
[4] J. Sarka and A. G. Császár, Interpretation of the Vibrational Energy Level
Structure of the Astructural Molecular Ion H5+ and All of
Its Deuterated Isotopomers, J. Chem. Phys. 2016, 144, 154309. http://dx.doi.org/10.1063/1.4946808
PDF (9532 kB)
[5] Y. Ajali, T. Trabelsi, O.
Denis-Alpiraz, T. Stoecklin, A. G.
Császár, M. Mogren Al-Mogren, J. S. Francisco, and M. Hochlaf, Vibrational
Memory in Quantum Localized States, Phys.
Rev. A 2016, 93, 052514. http://dx.doi.org/10.1103/PhysRevA.93.052514
PDF (1540 kB)
[6] T. Furtenbacher, I. Szabó, A. G. Császár, P. F. Bernath, S. N. Yurchenko,
and J. Tennyson, Experimental Energy Levels and the Related High-Temperature
Partition Function of the 12C2 Molecule, Astrophys. J. Suppl. 2016, 224, 44. http://dx.doi.org/10.3847/0067-0049/224/2/44
PDF (1067 kB)
[7] J. Sarka, D. Lauvergnat, V. Brites, A. G. Császár, and C. Léonard,
Rovibrational Energy Levels of the F-(H2O)
and F-(D2O)
Complexes, Phys. Chem. Chem. Phys. 2016,
18, 17678-17690. http://dx.doi.org/10.1039/C6CP02874H
PDF (2326 kB)
[8] H. Chung, B. J. Braams, K. Bartschat,
A. G. Császár, G. W. F. Drake, T.
Kirchner, V. Kokoouline, and J. Tennyson, Uncertainty Estimates for Theoretical
Atomic and Molecular Data, J. Phys. D
2016, 49, 363002. http://stacks.iop.org/0022-3727/49/i=36/a=363002
PDF (1922 kB)
[9] J. Sarka, A. G. Császár, S. C. Althorpe, D. J. Wales, and E. Mátyus,
Rovibrational Transitions of the Methane-Water Dimer from Intermolecular
Quantum Dynamical Computations, Phys. Chem. Chem. Phys. 2016, 18, 22816-22826. http://dx.doi.org/10.1039/c6cp03062a
PDF (4619 kB)
[10] A.
G. Császár, T. Furtenbacher, and P. Árendás, Small Molecules – Big Data, J. Phys. Chem. A 2016, 120, 8949–8969. http://dx.doi.org/10.1021/acs.jpca.6b02293
PDF (7873 kB)
[11] T.
Furtenbacher, T. Szidarovszky, J. Hruby, A. A. Kyuberis, N. F. Zobov, O. L.
Polyansky, J. Tennyson, and A. G.
Császár, Definitive Ideal-Gas Thermochemical Functions of the H216O
Molecule, J. Phys. Chem. Ref. Data 2016, 45, 043104. http://dx.doi.org/10.1063/1.4967723
PDF (1469 kB)