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Fabiano, E., Groenhof, G., Thiel, W. (2008) Approximate switching algorithms for trajectory surface hopping. Chemical Physics, 351. 111-116 doi:10.1016/j.chemphys.2008.04.003

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Reference TypeJournal (article/letter/editorial)
TitleApproximate switching algorithms for trajectory surface hopping
JournalChemical Physics
AuthorsFabiano, E.Author
Groenhof, G.Author
Thiel, W.Author
Year2008 (July)Volume351
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2008.04.003Search in ResearchGate
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Mindat Ref. ID5961718Long-form Identifiermindat:1:5:5961718:5
GUID0
Full ReferenceFabiano, E., Groenhof, G., Thiel, W. (2008) Approximate switching algorithms for trajectory surface hopping. Chemical Physics, 351. 111-116 doi:10.1016/j.chemphys.2008.04.003
Plain TextFabiano, E., Groenhof, G., Thiel, W. (2008) Approximate switching algorithms for trajectory surface hopping. Chemical Physics, 351. 111-116 doi:10.1016/j.chemphys.2008.04.003
In(n.d.) Chemical Physics Vol. 351. Elsevier BV

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Fabiano, E., Keal, T.W., Thiel, W. (2008) Implementation of surface hopping molecular dynamics using semiempirical methods. Chemical Physics, 349. 334-347 doi:10.1016/j.chemphys.2008.01.044
Herman, Michael F. (2008) Higher order phase corrected transition amplitudes for time dependent semiclassical surface hopping calculations. Chemical Physics, 351. 51-56 doi:10.1016/j.chemphys.2008.03.033
Fabiano, E., Thiel, W. (2008) Nonradiative Deexcitation Dynamics of 9H-Adenine: An OM2 Surface Hopping Study. The Journal of Physical Chemistry A, 112 (30). 6859-6863 doi:10.1021/jp8033402
Cui, Ganglong, Thiel, Walter (2014) Generalized trajectory surface-hopping method for internal conversion and intersystem crossing. The Journal of Chemical Physics, 141 (12). 124101pp. doi:10.1063/1.4894849
Spörkel, Lasse, Thiel, Walter (2016) Adaptive time steps in trajectory surface hopping simulations. The Journal of Chemical Physics, 144 (19). 194108pp. doi:10.1063/1.4948956
Jasper, Ahren W., Stechmann, Samuel N., Truhlar, Donald G. (2002) Fewest-switches with time uncertainty: A modified trajectory surface-hopping algorithm with better accuracy for classically forbidden electronic transitions. The Journal of Chemical Physics, 116 (13). 5424-5431 doi:10.1063/1.1453404
Jasper, Ahren W., Stechmann, Samuel N., Truhlar, Donald G. (2002) Erratum: “Fewest-switches with time uncertainty: A modified trajectory surface-hopping algorithm with better accuracy for classically forbidden electronic transitions” [J. Chem. Phys. 116, 5424 (2002)]. The Journal of Chemical Physics, 117 (22). 10427 doi:10.1063/1.1519005
Huang, Xun, Herman, Michael F. (2008) Numerical studies concerning the efficiency of various techniques in time-independent surface hopping calculations. Chemical Physics, 353. 139-144 doi:10.1016/j.chemphys.2008.08.004
Schmatz, Stefan (2008) Approximate calculation of anharmonic densities of vibrational states for very large molecules. Chemical Physics, 346. 198-211 doi:10.1016/j.chemphys.2008.01.020
Mukherjee, Soumya, Hazra, Saikat, Ghosh, Sandip, Mukherjee, Saikat, Adhikari, Satrajit (2022) Trajectory surface hopping vs. quantum scattering calculations on D+ + H2 and H + H2+ reactions using ab initio surfaces and couplings. Chemical Physics, 560. 111588 doi:10.1016/j.chemphys.2022.111588
Curchod, Basile F. E., Tavernelli, Ivano (2013) On trajectory-based nonadiabatic dynamics: Bohmian dynamics versus trajectory surface hopping. The Journal of Chemical Physics, 138 (18). 184112pp. doi:10.1063/1.4803835
 
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