Nominator's project description
| Dr. Mahapatra has made important contributions to the theoretical understanding of nonadiabatic chemical reaction dynamics both in bimolecular collisions and in unimolecular reactions. The aim of the research project at the Technical University of Munich and the University of Heidelberg is a first-principles investigation of the photochemistry of the allyl radiacal that plays a central role in many organic reactions. |
Publications (partial selection)
| 2004 | Susanta Mahapatra and Subhas Ghosal: A time-dependent wave packet study of the vibronic and spin-orbit interactions in the dynamics of Cl(2P)+H2->HCl(X1 Sigma g +)+H(2S) reaction. In: J. of Chem. Phys, 2004, 5740-5753 |
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| 2004 | Susanta Mahapatra, V. Vallet, C. Woywod, H. Köppel and W. Domcke: Multimode Jahn-Teller and pseudo-Jahn-Teller coupling effects in the photoelectron spectrum of CH3F. In: Chem. Phys, 2004, 17-34 |
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| 2004 | Susanta Mahapatra: Quantum Reaction Dynamics on Coupled Multi-Sheeted Potential Energy Surfaces (Chapter 13). In: Wolfgang Domcke, David R. Yarkony and Horst Köppel, Conical Intersections. Electronic structure, dynamics & spectroscopy (= Advanced Series in Physical Chemistry, Vol. 15). World Scientific, 2004. 555-581 |
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| 2004 | Susanta Mahapatra and R. Padmanaban: Resonances in three-dimensional H+HLi scattering: A time-dependent wave packet dynamical study. In: J. of Chem. Phys, 2004, 1746-1755 |
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| 2004 | Susanta Mahapatra: Spectroscopy and reactive scattering dynamics at conical intersections of potential energy surfaces. Quantum Dynamics at Conical Intersections. CCP6, 2004. 73-80 |
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| 2004 | Susanta Mahapatra, T.S. Venkatesan, L.S. Cederbaum and H. Köppel: Theoretical Investigation of Jahn-Teller Dynamics in 2E' Electronic Ground State of the Cyclopropane Radial Cation. In: J. Phys. Chem. A, 2004, 2256-2267 |
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| 2004 | Susanta Mahapatra and Subhas Ghosal: Theoretical study of the photodetachment spectroscopy of ClH2-. In: Chem. Phys. Lett, 2004, 207-214 |
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| 2004 | Susanta Mahapatra, V. Vallet, Z. Lan, A.L. Sobolewski and W. Domcke: Time-dependent quantum wave-packet description of the 1pi-sigma* photochemistry of pyrrole. In: Faraday Discuss, 2004, 283-293 |
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